A1BES
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OR8 | CR5 | sing | 1.43Å | 1.43Å | |
| OP4 | P1 | doub | 1.48Å | 1.49Å | |
| O44 | C43 | doub | 1.21Å | 1.27Å | |
| CR5 | CR4 | sing | 1.53Å | 1.48Å | |
| CR3 | CR4 | sing | 1.55Å | 1.51Å | |
| CR3 | CR2 | sing | 1.55Å | 1.52Å | |
| CR3 | OP2 | sing | 1.43Å | 1.43Å | |
| OR6 | CR1 | sing | 1.44Å | 1.40Å | |
| OR6 | CR4 | sing | 1.44Å | 1.44Å | |
| P1 | OP5 | sing | 1.61Å | 1.48Å | |
| P1 | OP2 | sing | 1.61Å | 1.62Å | |
| P1 | OP3 | sing | 1.61Å | 1.57Å | |
| C49 | C50 | sing | 1.51Å | 1.50Å | |
| C49 | C48 | sing | 1.53Å | 1.54Å | |
| CR1 | CR2 | sing | 1.54Å | 1.55Å | |
| CR1 | NB1 | sing | 1.47Å | 1.46Å | |
| C43 | N45 | sing | 1.35Å | 1.34Å | |
| C43 | C42 | sing | 1.51Å | 1.50Å | |
| CR2 | OR7 | sing | 1.43Å | 1.41Å | |
| N52 | C50 | sing | 1.35Å | 1.33Å | |
| C50 | O51 | doub | 1.21Å | 1.23Å | |
| CB11 | CB6 | sing | 1.51Å | 1.50Å | |
| CPR3 | CPR2 | sing | 1.53Å | 1.52Å | |
| CB7 | CB6 | doub | 1.38Å | 1.39Å | Aromatic |
| CB7 | CB8 | sing | 1.39Å | 1.38Å | Aromatic |
| CPR2 | OP3 | sing | 1.43Å | 1.46Å | |
| CPR2 | CPR1 | sing | 1.53Å | 1.53Å | |
| C47 | C12 | sing | 1.52Å | 1.54Å | |
| C48 | C13 | sing | 1.53Å | 1.56Å | |
| C42 | C41 | sing | 1.53Å | 1.52Å | |
| NB1 | CB8 | sing | 1.38Å | 1.38Å | Aromatic |
| NB1 | CB2 | sing | 1.36Å | 1.36Å | Aromatic |
| CB6 | CB5 | sing | 1.39Å | 1.40Å | Aromatic |
| CB8 | CB9 | doub | 1.40Å | 1.39Å | Aromatic |
| CPR1 | N59 | sing | 1.46Å | 1.45Å | |
| C12 | C13 | sing | 1.52Å | 1.56Å | |
| C12 | C11 | sing | 1.51Å | 1.52Å | |
| C12 | C46 | sing | 1.52Å | 1.56Å | |
| CB2 | NB3 | doub | 1.30Å | 1.34Å | Aromatic |
| C13 | C14 | sing | 1.52Å | 1.54Å | |
| CB5 | CB10 | sing | 1.51Å | 1.51Å | |
| CB5 | CB4 | doub | 1.37Å | 1.37Å | Aromatic |
| C41 | C8 | sing | 1.53Å | 1.55Å | |
| O58 | C57 | doub | 1.21Å | 1.24Å | |
| CB9 | NB3 | sing | 1.36Å | 1.40Å | Aromatic |
| CB9 | CB4 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.40Å | |
| C10 | C9 | doub | 1.37Å | 1.38Å | |
| C11 | N23 | doub | 1.33Å | 1.34Å | |
| N59 | C57 | sing | 1.35Å | 1.31Å | |
| C57 | C56 | sing | 1.51Å | 1.52Å | |
| C9 | C8 | sing | 1.51Å | 1.51Å | |
| C9 | N22 | sing | 1.34Å | 1.34Å | |
| C14 | N23 | sing | 1.34Å | 1.40Å | |
| C14 | C15 | doub | 1.37Å | 1.36Å | |
| C8 | C7 | sing | 1.52Å | 1.53Å | |
| N23 | CO1 | sing | 1.83Å | 1.91Å | |
| C56 | C55 | sing | 1.53Å | 1.53Å | |
| C53 | C15 | sing | 1.50Å | 1.52Å | |
| C15 | C16 | sing | 1.40Å | 1.44Å | |
| O39 | C38 | doub | 1.21Å | 1.26Å | |
| N22 | CO1 | sing | 1.82Å | 1.92Å | |
| N22 | C6 | doub | 1.33Å | 1.40Å | |
| CO1 | N24 | sing | 1.81Å | 1.91Å | |
| CO1 | N21 | sing | 1.81Å | 1.85Å | |
| CO1 | C1L | sing | 1.89Å | 1.90Å | |
| C7 | C36 | sing | 1.52Å | 1.54Å | |
| C7 | C6 | sing | 1.52Å | 1.55Å | |
| C7 | C37 | sing | 1.53Å | 1.56Å | |
| C55 | C17 | sing | 1.53Å | 1.53Å | |
| C16 | N24 | doub | 1.31Å | 1.31Å | |
| C16 | C17 | sing | 1.50Å | 1.56Å | |
| C6 | C5 | sing | 1.41Å | 1.38Å | |
| C20 | C1 | sing | 1.52Å | 1.52Å | |
| N24 | C19 | sing | 1.46Å | 1.48Å | |
| C38 | C37 | sing | 1.51Å | 1.49Å | |
| C38 | N40 | sing | 1.35Å | 1.31Å | |
| N21 | C1 | sing | 1.46Å | 1.50Å | |
| N21 | C4 | sing | 1.37Å | 1.29Å | |
| C17 | C18 | sing | 1.54Å | 1.53Å | |
| C17 | C54 | sing | 1.53Å | 1.54Å | |
| O33 | C32 | doub | 1.21Å | 1.23Å | |
| C1L | C2L | trip | 1.17Å | 1.24Å | |
| O62 | C61 | doub | 1.21Å | 1.24Å | |
| C4L | C5L | doub | 1.38Å | 1.38Å | Aromatic |
| C4L | C3L | sing | 1.40Å | 1.41Å | Aromatic |
| C5 | C4 | doub | 1.35Å | 1.45Å | |
| C5 | C35 | sing | 1.50Å | 1.52Å | |
| C1 | C19 | sing | 1.52Å | 1.54Å | |
| C1 | C2 | sing | 1.53Å | 1.58Å | |
| C18 | C19 | sing | 1.54Å | 1.52Å | |
| C18 | C60 | sing | 1.52Å | 1.55Å | |
| C4 | C3 | sing | 1.49Å | 1.51Å | |
| C5L | C6L | sing | 1.39Å | 1.39Å | Aromatic |
| C30 | C3 | sing | 1.53Å | 1.53Å | |
| C30 | C31 | sing | 1.53Å | 1.53Å | |
| C32 | N34 | sing | 1.35Å | 1.34Å | |
| C32 | C31 | sing | 1.51Å | 1.53Å | |
| C2L | C3L | sing | 1.43Å | 1.46Å | |
| C3L | C8L | doub | 1.40Å | 1.42Å | Aromatic |
| C61 | C60 | sing | 1.51Å | 1.53Å | |
| C61 | N63 | sing | 1.35Å | 1.32Å | |
| C3 | C2 | sing | 1.54Å | 1.57Å | |
| C2 | C25 | sing | 1.53Å | 1.54Å | |
| C2 | C26 | sing | 1.52Å | 1.56Å | |
| C6L | O01 | sing | 1.36Å | 1.35Å | |
| C6L | C7L | doub | 1.39Å | 1.39Å | Aromatic |
| O01 | C01 | sing | 1.43Å | 1.43Å | |
| C8L | C7L | sing | 1.38Å | 1.41Å | Aromatic |
| C26 | C27 | sing | 1.51Å | 1.53Å | |
| C27 | O28 | doub | 1.21Å | 1.26Å | |
| C27 | N29 | sing | 1.35Å | 1.33Å | |
| C3 | H2 | sing | 1.08Å | 1.10Å | |
| CB2 | H3 | sing | 1.08Å | 1.08Å | |
| C01 | H4 | sing | 1.09Å | 1.10Å | |
| C01 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.08Å | 1.08Å | |
| C13 | H10 | sing | 1.08Å | 1.10Å | |
| C18 | H14 | sing | 1.08Å | 1.10Å | |
| C19 | H15 | sing | 1.08Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C30 | H25 | sing | 1.09Å | 1.10Å | |
| C31 | H26 | sing | 1.09Å | 1.10Å | |
| C31 | H27 | sing | 1.09Å | 1.10Å | |
| C35 | H28 | sing | 1.09Å | 1.10Å | |
| C35 | H29 | sing | 1.09Å | 1.10Å | |
| C35 | H30 | sing | 1.09Å | 1.10Å | |
| C36 | H31 | sing | 1.09Å | 1.10Å | |
| C36 | H32 | sing | 1.09Å | 1.10Å | |
| C36 | H33 | sing | 1.09Å | 1.10Å | |
| C37 | H34 | sing | 1.09Å | 1.10Å | |
| C37 | H35 | sing | 1.09Å | 1.10Å | |
| C41 | H36 | sing | 1.09Å | 1.10Å | |
| C41 | H37 | sing | 1.09Å | 1.10Å | |
| C42 | H38 | sing | 1.09Å | 1.10Å | |
| C42 | H39 | sing | 1.09Å | 1.10Å | |
| C46 | H40 | sing | 1.09Å | 1.10Å | |
| C46 | H41 | sing | 1.09Å | 1.10Å | |
| C46 | H42 | sing | 1.09Å | 1.10Å | |
| C47 | H43 | sing | 1.09Å | 1.10Å | |
| C47 | H44 | sing | 1.09Å | 1.10Å | |
| C47 | H45 | sing | 1.09Å | 1.10Å | |
| C48 | H46 | sing | 1.09Å | 1.10Å | |
| C48 | H47 | sing | 1.09Å | 1.10Å | |
| C49 | H48 | sing | 1.09Å | 1.10Å | |
| C49 | H49 | sing | 1.09Å | 1.10Å | |
| C4L | H50 | sing | 1.08Å | 1.08Å | |
| C53 | H51 | sing | 1.09Å | 1.10Å | |
| C53 | H52 | sing | 1.09Å | 1.10Å | |
| C53 | H53 | sing | 1.09Å | 1.10Å | |
| C54 | H54 | sing | 1.09Å | 1.10Å | |
| C54 | H55 | sing | 1.09Å | 1.10Å | |
| C54 | H56 | sing | 1.09Å | 1.10Å | |
| C55 | H57 | sing | 1.09Å | 1.10Å | |
| C55 | H58 | sing | 1.09Å | 1.10Å | |
| C56 | H59 | sing | 1.09Å | 1.10Å | |
| C56 | H60 | sing | 1.09Å | 1.10Å | |
| C5L | H61 | sing | 1.08Å | 1.08Å | |
| C60 | H62 | sing | 1.09Å | 1.10Å | |
| C60 | H63 | sing | 1.09Å | 1.10Å | |
| C7L | H64 | sing | 1.08Å | 1.08Å | |
| C8 | H65 | sing | 1.08Å | 1.10Å | |
| C8L | H66 | sing | 1.08Å | 1.08Å | |
| CB4 | H68 | sing | 1.08Å | 1.08Å | |
| CB7 | H69 | sing | 1.08Å | 1.08Å | |
| CR1 | H70 | sing | 1.09Å | 1.10Å | |
| CR2 | H71 | sing | 1.09Å | 1.10Å | |
| CR3 | H72 | sing | 1.09Å | 1.10Å | |
| CR4 | H73 | sing | 1.09Å | 1.10Å | |
| CR5 | H74 | sing | 1.09Å | 1.10Å | |
| CR5 | H75 | sing | 1.09Å | 1.10Å | |
| N29 | H76 | sing | 0.97Å | 1.00Å | |
| N29 | H77 | sing | 0.97Å | 1.00Å | |
| N34 | H78 | sing | 0.97Å | 1.00Å | |
| N34 | H79 | sing | 0.97Å | 1.00Å | |
| N40 | H80 | sing | 0.97Å | 1.00Å | |
| N40 | H81 | sing | 0.97Å | 1.00Å | |
| N45 | H82 | sing | 0.97Å | 1.00Å | |
| N45 | H83 | sing | 0.97Å | 1.00Å | |
| N52 | H84 | sing | 0.97Å | 1.00Å | |
| N52 | H85 | sing | 0.97Å | 1.00Å | |
| N59 | H86 | sing | 0.97Å | 1.00Å | |
| N63 | H87 | sing | 0.97Å | 1.00Å | |
| N63 | H88 | sing | 0.97Å | 1.00Å | |
| OP5 | H89 | sing | 0.97Å | 0.95Å | |
| OR7 | H90 | sing | 0.97Å | 0.95Å | |
| OR8 | H91 | sing | 0.97Å | 0.95Å | |
| CB10 | H92 | sing | 1.09Å | 1.10Å | |
| CB10 | H93 | sing | 1.09Å | 1.10Å | |
| CB10 | H94 | sing | 1.09Å | 1.10Å | |
| CB11 | H95 | sing | 1.09Å | 1.10Å | |
| CB11 | H96 | sing | 1.09Å | 1.10Å | |
| CB11 | H97 | sing | 1.09Å | 1.10Å | |
| CPR1 | H98 | sing | 1.09Å | 1.10Å | |
| CPR1 | H99 | sing | 1.09Å | 1.10Å | |
| CPR2 | H1 | sing | 1.09Å | 1.10Å | |
| CPR3 | H8 | sing | 1.09Å | 1.10Å | |
| CPR3 | H11 | sing | 1.09Å | 1.10Å | |
| CPR3 | H9 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OR8 | CR5 | CR4 | 110.7° | 109.5° |
| OR8 | CR5 | H74 | 109.2° | 109.4° |
| OR8 | CR5 | H75 | 109.1° | 109.5° |
| CR5 | OR8 | H91 | 109.5° | 114.1° |
| OP4 | P1 | OP5 | 119.7° | 109.5° |
| OP4 | P1 | OP2 | 107.3° | 109.5° |
| OP4 | P1 | OP3 | 114.8° | 109.5° |
| O44 | C43 | N45 | 124.1° | 120.0° |
| O44 | C43 | C42 | 120.1° | 120.0° |
| CR5 | CR4 | CR3 | 116.8° | 110.6° |
| CR5 | CR4 | OR6 | 108.2° | 110.8° |
| CR5 | CR4 | H73 | 109.6° | 110.5° |
| CR4 | CR5 | H74 | 109.1° | 109.5° |
| CR4 | CR5 | H75 | 109.2° | 109.5° |
| CR4 | CR3 | CR2 | 99.2° | 102.1° |
| CR4 | CR3 | OP2 | 107.3° | 111.0° |
| CR3 | CR4 | OR6 | 102.4° | 103.5° |
| CR4 | CR3 | H72 | 111.4° | 110.9° |
| CR3 | CR4 | H73 | 109.3° | 110.6° |
| CR2 | CR3 | OP2 | 114.4° | 110.9° |
| CR3 | CR2 | CR1 | 102.7° | 104.2° |
| CR3 | CR2 | OR7 | 110.0° | 110.5° |
| CR3 | CR2 | H71 | 111.0° | 110.6° |
| CR2 | CR3 | H72 | 111.2° | 110.9° |
| CR3 | OP2 | P1 | 123.2° | 123.0° |
| OP2 | CR3 | H72 | 112.6° | 110.8° |
| CR1 | OR6 | CR4 | 108.9° | 107.0° |
| OR6 | CR1 | CR2 | 105.6° | 107.3° |
| OR6 | CR1 | NB1 | 110.5° | 109.9° |
| OR6 | CR1 | H70 | 110.4° | 110.0° |
| OR6 | CR4 | H73 | 110.3° | 110.6° |
| OP5 | P1 | OP2 | 115.8° | 109.5° |
| OP5 | P1 | OP3 | 100.6° | 109.4° |
| P1 | OP5 | H89 | 109.5° | 114.0° |
| OP2 | P1 | OP3 | 96.2° | 109.5° |
| P1 | OP3 | CPR2 | 122.3° | 123.0° |
| C50 | C49 | C48 | 109.9° | 109.5° |
| C49 | C50 | N52 | 117.7° | 120.0° |
| C49 | C50 | O51 | 118.3° | 120.0° |
| C50 | C49 | H48 | 109.4° | 109.5° |
| C50 | C49 | H49 | 109.4° | 109.4° |
| C49 | C48 | C13 | 118.3° | 109.5° |
| C49 | C48 | H46 | 107.2° | 109.5° |
| C49 | C48 | H47 | 107.2° | 109.5° |
| C48 | C49 | H48 | 109.3° | 109.5° |
| C48 | C49 | H49 | 109.3° | 109.4° |
| CR2 | CR1 | NB1 | 112.5° | 109.8° |
| CR1 | CR2 | OR7 | 109.4° | 110.5° |
| CR2 | CR1 | H70 | 108.3° | 109.9° |
| CR1 | CR2 | H71 | 110.6° | 110.5° |
| CR1 | NB1 | CB8 | 126.6° | 126.3° |
| CR1 | NB1 | CB2 | 128.4° | 126.4° |
| NB1 | CR1 | H70 | 109.5° | 109.9° |
| N45 | C43 | C42 | 115.8° | 120.0° |
| C43 | N45 | H82 | 120.0° | 120.0° |
| C43 | N45 | H83 | 120.0° | 120.0° |
| C43 | C42 | C41 | 112.0° | 109.5° |
| C43 | C42 | H38 | 108.8° | 109.5° |
| C43 | C42 | H39 | 108.8° | 109.5° |
| OR7 | CR2 | H71 | 112.7° | 110.4° |
| CR2 | OR7 | H90 | 109.5° | 114.0° |
| N52 | C50 | O51 | 124.1° | 120.0° |
| C50 | N52 | H84 | 120.0° | 120.0° |
| C50 | N52 | H85 | 120.0° | 120.0° |
| CB11 | CB6 | CB7 | 118.3° | 119.8° |
| CB11 | CB6 | CB5 | 119.8° | 119.7° |
| CB6 | CB11 | H95 | 109.5° | 109.5° |
| CB6 | CB11 | H96 | 109.5° | 109.4° |
| CB6 | CB11 | H97 | 109.5° | 109.5° |
| CPR3 | CPR2 | OP3 | 105.5° | 109.5° |
| CPR3 | CPR2 | CPR1 | 108.2° | 109.5° |
| CPR3 | CPR2 | H1 | 111.7° | 109.5° |
| CPR2 | CPR3 | H8 | 109.5° | 109.5° |
| CPR2 | CPR3 | H11 | 109.5° | 109.4° |
| CPR2 | CPR3 | H9 | 109.5° | 109.5° |
| CB6 | CB7 | CB8 | 117.1° | 119.7° |
| CB7 | CB6 | CB5 | 121.8° | 120.5° |
| CB6 | CB7 | H69 | 121.5° | 120.2° |
| CB7 | CB8 | NB1 | 130.2° | 134.1° |
| CB7 | CB8 | CB9 | 122.1° | 119.9° |
| CB8 | CB7 | H69 | 121.5° | 120.2° |
| OP3 | CPR2 | CPR1 | 106.9° | 109.5° |
| OP3 | CPR2 | H1 | 112.7° | 109.5° |
| CPR2 | CPR1 | N59 | 116.8° | 109.5° |
| CPR2 | CPR1 | H98 | 107.6° | 109.5° |
| CPR2 | CPR1 | H99 | 107.6° | 109.4° |
| CPR1 | CPR2 | H1 | 111.5° | 109.5° |
| C47 | C12 | C13 | 119.2° | 110.8° |
| C47 | C12 | C11 | 110.7° | 110.5° |
| C47 | C12 | C46 | 109.7° | 111.1° |
| C12 | C47 | H43 | 109.5° | 109.4° |
| C12 | C47 | H44 | 109.5° | 109.5° |
| C12 | C47 | H45 | 109.4° | 109.5° |
| C48 | C13 | C12 | 115.3° | 110.8° |
| C48 | C13 | C14 | 113.5° | 110.5° |
| C48 | C13 | H10 | 108.7° | 111.1° |
| C13 | C48 | H46 | 107.2° | 109.5° |
| C13 | C48 | H47 | 107.2° | 109.4° |
| C42 | C41 | C8 | 117.7° | 109.5° |
| C42 | C41 | H36 | 107.4° | 109.5° |
| C42 | C41 | H37 | 107.4° | 109.5° |
| C41 | C42 | H38 | 108.8° | 109.5° |
| C41 | C42 | H39 | 108.8° | 109.5° |
| CB8 | NB1 | CB2 | 104.9° | 107.3° |
| NB1 | CB8 | CB9 | 107.7° | 106.0° |
| NB1 | CB2 | NB3 | 114.5° | 110.1° |
| NB1 | CB2 | H3 | 122.7° | 124.9° |
| CB6 | CB5 | CB10 | 120.0° | 119.7° |
| CB6 | CB5 | CB4 | 120.2° | 120.6° |
| CB8 | CB9 | NB3 | 109.0° | 107.0° |
| CB8 | CB9 | CB4 | 120.2° | 119.5° |
| CPR1 | N59 | C57 | 119.6° | 120.0° |
| CPR1 | N59 | H86 | 120.2° | 120.0° |
| N59 | CPR1 | H98 | 107.6° | 109.5° |
| N59 | CPR1 | H99 | 107.6° | 109.5° |
| C13 | C12 | C11 | 101.6° | 102.5° |
| C13 | C12 | C46 | 104.7° | 110.8° |
| C12 | C13 | C14 | 101.5° | 102.6° |
| C12 | C13 | H10 | 108.7° | 110.9° |
| C11 | C12 | C46 | 110.5° | 110.8° |
| C12 | C11 | C10 | 123.4° | 120.4° |
| C12 | C11 | N23 | 111.1° | 112.3° |
| C12 | C46 | H40 | 109.5° | 109.5° |
| C12 | C46 | H41 | 109.5° | 109.5° |
| C12 | C46 | H42 | 109.5° | 109.5° |
| CB2 | NB3 | CB9 | 104.0° | 109.6° |
| NB3 | CB2 | H3 | 122.8° | 124.9° |
| C13 | C14 | N23 | 109.2° | 111.7° |
| C13 | C14 | C15 | 124.3° | 117.0° |
| C14 | C13 | H10 | 108.9° | 110.7° |
| CB10 | CB5 | CB4 | 119.8° | 119.7° |
| CB5 | CB10 | H92 | 109.5° | 109.5° |
| CB5 | CB10 | H93 | 109.4° | 109.5° |
| CB5 | CB10 | H94 | 109.5° | 109.5° |
| CB5 | CB4 | CB9 | 118.7° | 119.9° |
| CB5 | CB4 | H68 | 120.7° | 120.1° |
| C41 | C8 | C9 | 109.1° | 110.8° |
| C41 | C8 | C7 | 111.2° | 110.6° |
| C8 | C41 | H36 | 107.4° | 109.5° |
| C8 | C41 | H37 | 107.3° | 109.5° |
| C41 | C8 | H65 | 110.9° | 111.3° |
| O58 | C57 | N59 | 120.3° | 120.0° |
| O58 | C57 | C56 | 121.0° | 120.0° |
| NB3 | CB9 | CB4 | 130.9° | 133.6° |
| CB9 | CB4 | H68 | 120.7° | 120.1° |
| C11 | C10 | C9 | 125.7° | 120.3° |
| C10 | C11 | N23 | 125.5° | 127.3° |
| C11 | C10 | H7 | 117.1° | 120.2° |
| C10 | C9 | C8 | 123.2° | 119.5° |
| C10 | C9 | N22 | 125.1° | 127.3° |
| C9 | C10 | H7 | 117.2° | 119.5° |
| C11 | N23 | C14 | 110.5° | 110.3° |
| C11 | N23 | CO1 | 122.0° | 123.1° |
| N59 | C57 | C56 | 118.6° | 120.0° |
| C57 | N59 | H86 | 120.2° | 120.0° |
| C57 | C56 | C55 | 105.9° | 109.5° |
| C57 | C56 | H59 | 110.4° | 109.5° |
| C57 | C56 | H60 | 110.3° | 109.5° |
| C8 | C9 | N22 | 110.5° | 113.0° |
| C9 | C8 | C7 | 102.9° | 102.1° |
| C9 | C8 | H65 | 111.4° | 111.0° |
| C9 | N22 | CO1 | 122.3° | 123.1° |
| C9 | N22 | C6 | 110.3° | 109.4° |
| N23 | C14 | C15 | 126.5° | 131.3° |
| C14 | N23 | CO1 | 127.0° | 126.6° |
| C14 | C15 | C53 | 116.1° | 121.3° |
| C14 | C15 | C16 | 121.5° | 116.5° |
| C8 | C7 | C36 | 107.2° | 111.3° |
| C8 | C7 | C6 | 100.1° | 103.0° |
| C8 | C7 | C37 | 110.5° | 110.3° |
| C7 | C8 | H65 | 111.1° | 110.7° |
| N23 | CO1 | N22 | 97.5° | 97.3° |
| N23 | CO1 | N24 | 88.7° | 86.6° |
| N23 | CO1 | N21 | 172.8° | 161.2° |
| N23 | CO1 | C1L | 88.1° | 97.3° |
| C56 | C55 | C17 | 115.6° | 109.5° |
| C56 | C55 | H57 | 107.9° | 109.4° |
| C56 | C55 | H58 | 107.9° | 109.5° |
| C55 | C56 | H59 | 110.4° | 109.4° |
| C55 | C56 | H60 | 110.4° | 109.5° |
| C53 | C15 | C16 | 121.4° | 122.2° |
| C15 | C53 | H51 | 109.5° | 109.5° |
| C15 | C53 | H52 | 109.4° | 109.5° |
| C15 | C53 | H53 | 109.5° | 109.5° |
| C15 | C16 | N24 | 120.5° | 118.2° |
| C15 | C16 | C17 | 128.4° | 129.1° |
| O39 | C38 | C37 | 123.2° | 120.0° |
| O39 | C38 | N40 | 120.9° | 120.0° |
| CO1 | N22 | C6 | 125.7° | 127.3° |
| N22 | CO1 | N24 | 172.7° | 162.5° |
| N22 | CO1 | N21 | 89.7° | 84.4° |
| N22 | CO1 | C1L | 83.2° | 98.6° |
| N22 | C6 | C7 | 109.0° | 112.4° |
| N22 | C6 | C5 | 121.8° | 131.9° |
| N24 | CO1 | N21 | 84.1° | 86.6° |
| N24 | CO1 | C1L | 93.2° | 97.8° |
| CO1 | N24 | C16 | 134.6° | 140.4° |
| CO1 | N24 | C19 | 113.7° | 110.5° |
| N21 | CO1 | C1L | 92.8° | 101.0° |
| CO1 | N21 | C1 | 115.4° | 112.2° |
| CO1 | N21 | C4 | 129.1° | 140.6° |
| CO1 | C1L | C2L | 164.5° | 179.9° |
| C36 | C7 | C6 | 121.3° | 110.7° |
| C36 | C7 | C37 | 112.9° | 111.1° |
| C7 | C36 | H31 | 109.5° | 109.5° |
| C7 | C36 | H32 | 109.5° | 109.4° |
| C7 | C36 | H33 | 109.5° | 109.5° |
| C6 | C7 | C37 | 104.0° | 110.2° |
| C7 | C6 | C5 | 128.5° | 115.6° |
| C7 | C37 | C38 | 114.5° | 109.4° |
| C7 | C37 | H34 | 108.2° | 109.5° |
| C7 | C37 | H35 | 108.2° | 109.5° |
| C55 | C17 | C16 | 117.7° | 110.6° |
| C55 | C17 | C18 | 107.4° | 110.8° |
| C55 | C17 | C54 | 108.5° | 111.0° |
| C17 | C55 | H57 | 107.9° | 109.5° |
| C17 | C55 | H58 | 107.9° | 109.5° |
| N24 | C16 | C17 | 110.1° | 112.7° |
| C16 | N24 | C19 | 110.2° | 109.0° |
| C16 | C17 | C18 | 101.3° | 103.6° |
| C16 | C17 | C54 | 112.5° | 109.7° |
| C6 | C5 | C4 | 121.3° | 115.8° |
| C6 | C5 | C35 | 122.6° | 122.0° |
| C20 | C1 | N21 | 112.6° | 111.7° |
| C20 | C1 | C19 | 106.5° | 111.5° |
| C20 | C1 | C2 | 113.1° | 111.4° |
| C1 | C20 | H16 | 109.5° | 109.5° |
| C1 | C20 | H17 | 109.5° | 109.5° |
| C1 | C20 | H18 | 109.5° | 109.5° |
| N24 | C19 | C1 | 104.8° | 102.0° |
| N24 | C19 | C18 | 101.7° | 106.9° |
| N24 | C19 | H15 | 111.6° | 111.5° |
| C37 | C38 | N40 | 115.9° | 120.0° |
| C38 | C37 | H34 | 108.2° | 109.5° |
| C38 | C37 | H35 | 108.2° | 109.4° |
| C38 | N40 | H80 | 120.0° | 120.0° |
| C38 | N40 | H81 | 120.0° | 120.0° |
| C1 | N21 | C4 | 113.7° | 107.2° |
| N21 | C1 | C19 | 103.9° | 103.6° |
| N21 | C1 | C2 | 101.8° | 106.6° |
| N21 | C4 | C5 | 124.3° | 116.9° |
| N21 | C4 | C3 | 110.5° | 112.1° |
| C18 | C17 | C54 | 108.9° | 110.9° |
| C17 | C18 | C19 | 103.2° | 100.4° |
| C17 | C18 | C60 | 118.2° | 110.4° |
| C17 | C18 | H14 | 105.3° | 111.6° |
| C17 | C54 | H54 | 109.5° | 109.5° |
| C17 | C54 | H55 | 109.5° | 109.5° |
| C17 | C54 | H56 | 109.5° | 109.5° |
| O33 | C32 | N34 | 123.0° | 120.0° |
| O33 | C32 | C31 | 122.4° | 120.0° |
| C1L | C2L | C3L | 167.8° | 180.0° |
| O62 | C61 | C60 | 123.5° | 120.0° |
| O62 | C61 | N63 | 118.1° | 120.0° |
| C5L | C4L | C3L | 123.5° | 120.0° |
| C4L | C5L | C6L | 119.5° | 120.0° |
| C5L | C4L | H50 | 118.3° | 120.0° |
| C4L | C5L | H61 | 120.3° | 120.0° |
| C4L | C3L | C2L | 115.5° | 120.1° |
| C4L | C3L | C8L | 115.4° | 119.8° |
| C3L | C4L | H50 | 118.2° | 120.0° |
| C4 | C5 | C35 | 114.8° | 122.2° |
| C5 | C4 | C3 | 124.2° | 130.9° |
| C5 | C35 | H28 | 109.5° | 109.5° |
| C5 | C35 | H29 | 109.5° | 109.4° |
| C5 | C35 | H30 | 109.5° | 109.4° |
| C19 | C1 | C2 | 118.6° | 111.7° |
| C1 | C19 | C18 | 116.6° | 111.3° |
| C1 | C19 | H15 | 110.7° | 113.2° |
| C1 | C2 | C3 | 102.2° | 101.9° |
| C1 | C2 | C25 | 111.5° | 111.1° |
| C1 | C2 | C26 | 110.7° | 111.3° |
| C19 | C18 | C60 | 118.3° | 110.7° |
| C19 | C18 | H14 | 105.4° | 111.3° |
| C18 | C19 | H15 | 110.9° | 111.3° |
| C18 | C60 | C61 | 109.8° | 109.4° |
| C60 | C18 | H14 | 105.1° | 111.9° |
| C18 | C60 | H62 | 109.4° | 109.5° |
| C18 | C60 | H63 | 109.4° | 109.5° |
| C4 | C3 | C30 | 112.1° | 110.6° |
| C4 | C3 | C2 | 100.3° | 104.2° |
| C4 | C3 | H2 | 108.8° | 110.6° |
| C5L | C6L | O01 | 115.6° | 119.9° |
| C5L | C6L | C7L | 120.5° | 120.2° |
| C6L | C5L | H61 | 120.3° | 120.0° |
| C3 | C30 | C31 | 116.6° | 109.4° |
| C30 | C3 | C2 | 118.6° | 110.3° |
| C30 | C3 | H2 | 108.6° | 110.7° |
| C3 | C30 | H24 | 107.6° | 109.5° |
| C3 | C30 | H25 | 107.6° | 109.5° |
| C30 | C31 | C32 | 112.9° | 109.5° |
| C31 | C30 | H24 | 107.7° | 109.4° |
| C31 | C30 | H25 | 107.7° | 109.5° |
| C30 | C31 | H26 | 108.6° | 109.5° |
| C30 | C31 | H27 | 108.6° | 109.5° |
| N34 | C32 | C31 | 114.6° | 120.0° |
| C32 | N34 | H78 | 120.0° | 120.0° |
| C32 | N34 | H79 | 120.0° | 120.0° |
| C32 | C31 | H26 | 108.6° | 109.4° |
| C32 | C31 | H27 | 108.6° | 109.4° |
| C2L | C3L | C8L | 129.1° | 120.1° |
| C3L | C8L | C7L | 121.6° | 119.9° |
| C3L | C8L | H66 | 119.2° | 120.1° |
| C60 | C61 | N63 | 118.5° | 120.0° |
| C61 | C60 | H62 | 109.4° | 109.5° |
| C61 | C60 | H63 | 109.4° | 109.5° |
| C61 | N63 | H87 | 120.0° | 120.0° |
| C61 | N63 | H88 | 120.0° | 120.0° |
| C3 | C2 | C25 | 115.0° | 110.7° |
| C3 | C2 | C26 | 107.4° | 110.5° |
| C2 | C3 | H2 | 108.0° | 110.4° |
| C25 | C2 | C26 | 109.7° | 111.0° |
| C2 | C25 | H19 | 109.5° | 109.5° |
| C2 | C25 | H20 | 109.5° | 109.4° |
| C2 | C25 | H21 | 109.5° | 109.5° |
| C2 | C26 | C27 | 112.8° | 109.5° |
| C2 | C26 | H22 | 108.6° | 109.5° |
| C2 | C26 | H23 | 108.6° | 109.5° |
| O01 | C6L | C7L | 124.0° | 119.9° |
| C6L | O01 | C01 | 111.6° | 117.0° |
| C6L | C7L | C8L | 119.6° | 120.1° |
| C6L | C7L | H64 | 120.2° | 120.0° |
| O01 | C01 | H4 | 109.5° | 109.5° |
| O01 | C01 | H5 | 109.5° | 109.5° |
| O01 | C01 | H6 | 109.4° | 109.4° |
| C8L | C7L | H64 | 120.2° | 120.0° |
| C7L | C8L | H66 | 119.2° | 120.0° |
| C26 | C27 | O28 | 122.6° | 120.0° |
| C26 | C27 | N29 | 116.4° | 120.0° |
| C27 | C26 | H22 | 108.6° | 109.5° |
| C27 | C26 | H23 | 108.6° | 109.4° |
| O28 | C27 | N29 | 121.1° | 120.0° |
| C27 | N29 | H76 | 120.0° | 120.0° |
| C27 | N29 | H77 | 120.0° | 120.0° |
| H4 | C01 | H5 | 109.5° | 109.5° |
| H4 | C01 | H6 | 109.5° | 109.5° |
| H5 | C01 | H6 | 109.5° | 109.4° |
| H16 | C20 | H17 | 109.5° | 109.5° |
| H16 | C20 | H18 | 109.5° | 109.4° |
| H17 | C20 | H18 | 109.5° | 109.5° |
| H19 | C25 | H20 | 109.4° | 109.5° |
| H19 | C25 | H21 | 109.5° | 109.5° |
| H20 | C25 | H21 | 109.5° | 109.5° |
| H22 | C26 | H23 | 109.4° | 109.5° |
| H24 | C30 | H25 | 109.5° | 109.5° |
| H26 | C31 | H27 | 109.5° | 109.5° |
| H28 | C35 | H29 | 109.5° | 109.5° |
| H28 | C35 | H30 | 109.4° | 109.5° |
| H29 | C35 | H30 | 109.5° | 109.5° |
| H31 | C36 | H32 | 109.4° | 109.4° |
| H31 | C36 | H33 | 109.5° | 109.5° |
| H32 | C36 | H33 | 109.5° | 109.5° |
| H34 | C37 | H35 | 109.4° | 109.5° |
| H36 | C41 | H37 | 109.5° | 109.5° |
| H38 | C42 | H39 | 109.4° | 109.4° |
| H40 | C46 | H41 | 109.4° | 109.5° |
| H40 | C46 | H42 | 109.5° | 109.4° |
| H41 | C46 | H42 | 109.5° | 109.5° |
| H43 | C47 | H44 | 109.5° | 109.5° |
| H43 | C47 | H45 | 109.5° | 109.4° |
| H44 | C47 | H45 | 109.5° | 109.5° |
| H46 | C48 | H47 | 109.5° | 109.4° |
| H48 | C49 | H49 | 109.5° | 109.5° |
| H51 | C53 | H52 | 109.4° | 109.5° |
| H51 | C53 | H53 | 109.5° | 109.5° |
| H52 | C53 | H53 | 109.5° | 109.4° |
| H54 | C54 | H55 | 109.5° | 109.5° |
| H54 | C54 | H56 | 109.4° | 109.4° |
| H55 | C54 | H56 | 109.5° | 109.4° |
| H57 | C55 | H58 | 109.5° | 109.5° |
| H59 | C56 | H60 | 109.5° | 109.5° |
| H62 | C60 | H63 | 109.4° | 109.5° |
| H74 | CR5 | H75 | 109.5° | 109.5° |
| H76 | N29 | H77 | 120.0° | 120.0° |
| H78 | N34 | H79 | 120.0° | 120.0° |
| H80 | N40 | H81 | 120.0° | 120.0° |
| H82 | N45 | H83 | 120.0° | 120.0° |
| H84 | N52 | H85 | 120.0° | 120.0° |
| H87 | N63 | H88 | 120.0° | 120.0° |
| H92 | CB10 | H93 | 109.5° | 109.5° |
| H92 | CB10 | H94 | 109.4° | 109.4° |
| H93 | CB10 | H94 | 109.5° | 109.5° |
| H95 | CB11 | H96 | 109.5° | 109.5° |
| H95 | CB11 | H97 | 109.5° | 109.5° |
| H96 | CB11 | H97 | 109.4° | 109.5° |
| H98 | CPR1 | H99 | 109.5° | 109.4° |
| H8 | CPR3 | H11 | 109.4° | 109.5° |
| H8 | CPR3 | H9 | 109.5° | 109.5° |
| H11 | CPR3 | H9 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OR8 | CR5 | CR4 | H74 | 120.2° | 120.0° |
| OR8 | CR5 | CR4 | H75 | 120.2° | 120.0° |
| OR8 | CR5 | CR4 | CR3 | 50.4° | 173.0° |
| OR8 | CR5 | CR4 | OR6 | 64.3° | 72.8° |
| OR8 | CR5 | CR4 | H73 | 175.4° | 50.1° |
| OR8 | CR5 | H74 | H75 | 119.4° | 120.0° |
| OP4 | P1 | OP2 | CR3 | 56.4° | 45.8° |
| OP4 | P1 | OP5 | OP2 | 131.0° | 120.0° |
| OP4 | P1 | OP5 | OP3 | 126.7° | 120.0° |
| OP4 | P1 | OP2 | OP3 | 118.4° | 120.0° |
| OP4 | P1 | OP3 | CPR2 | 44.4° | 62.4° |
| OP4 | P1 | OP5 | H89 | 0.0° | 180.0° |
| O44 | C43 | N45 | C42 | 179.3° | 180.0° |
| O44 | C43 | C42 | C41 | 152.4° | 0.0° |
| O44 | C43 | C42 | H38 | 32.0° | 120.0° |
| O44 | C43 | C42 | H39 | 87.2° | 120.1° |
| O44 | C43 | N45 | H82 | 0.0° | 180.0° |
| O44 | C43 | N45 | H83 | 180.0° | 0.0° |
| CR5 | CR4 | CR3 | OR6 | 117.9° | 118.7° |
| CR5 | CR4 | CR3 | H73 | 125.1° | 122.8° |
| CR5 | CR4 | CR3 | CR2 | 163.4° | 155.7° |
| CR5 | CR4 | CR3 | OP2 | 77.3° | 86.1° |
| CR5 | CR4 | OR6 | CR1 | 161.2° | 158.7° |
| CR5 | CR4 | OR6 | H73 | 119.9° | 122.9° |
| CR5 | CR4 | CR3 | H72 | 46.2° | 37.5° |
| CR4 | CR5 | H74 | H75 | 119.4° | 120.0° |
| CR4 | CR5 | OR8 | H91 | 180.0° | 178.5° |
| CR4 | CR3 | CR2 | OP2 | 113.8° | 118.2° |
| CR4 | CR3 | CR2 | H72 | 117.3° | 118.2° |
| CR4 | CR3 | OP2 | H72 | 122.8° | 123.7° |
| CR3 | CR4 | OR6 | CR1 | 37.3° | 40.1° |
| CR3 | CR4 | OR6 | H73 | 116.3° | 118.5° |
| CR4 | CR3 | OP2 | P1 | 157.1° | 133.1° |
| CR4 | CR3 | CR2 | CR1 | 37.4° | 20.9° |
| CR4 | CR3 | CR2 | OR7 | 78.9° | 97.8° |
| CR4 | CR3 | CR2 | H71 | 155.6° | 139.6° |
| CR3 | CR4 | CR5 | H74 | 69.8° | 53.1° |
| CR3 | CR4 | CR5 | H75 | 170.6° | 66.9° |
| CR2 | CR3 | OP2 | H72 | 128.2° | 123.6° |
| CR3 | CR2 | CR1 | OR6 | 16.8° | 2.0° |
| CR2 | CR3 | CR4 | OR6 | 45.5° | 37.0° |
| CR2 | CR3 | OP2 | P1 | 93.9° | 114.2° |
| CR3 | CR2 | CR1 | OR7 | 116.8° | 118.7° |
| CR3 | CR2 | CR1 | H71 | 118.5° | 118.8° |
| CR3 | CR2 | CR1 | NB1 | 137.4° | 117.4° |
| CR3 | CR2 | OR7 | H71 | 124.5° | 122.7° |
| CR3 | CR2 | CR1 | H70 | 101.5° | 121.6° |
| CR2 | CR3 | CR4 | H73 | 71.5° | 81.5° |
| CR3 | CR2 | OR7 | H90 | 180.0° | 176.2° |
| OP2 | CR3 | CR4 | OR6 | 164.8° | 155.2° |
| CR3 | OP2 | P1 | OP5 | 80.2° | 74.3° |
| CR3 | OP2 | P1 | OP3 | 174.9° | 165.8° |
| OP2 | CR3 | CR2 | CR1 | 151.2° | 139.1° |
| OP2 | CR3 | CR2 | OR7 | 34.9° | 20.4° |
| OP2 | CR3 | CR2 | H71 | 90.5° | 102.2° |
| OP2 | CR3 | CR4 | H73 | 47.8° | 36.7° |
| OR6 | CR1 | CR2 | NB1 | 120.6° | 119.4° |
| OR6 | CR1 | CR2 | H70 | 118.2° | 119.6° |
| OR6 | CR1 | NB1 | H70 | 121.7° | 121.2° |
| OR6 | CR1 | CR2 | OR7 | 100.0° | 120.7° |
| OR6 | CR1 | NB1 | CB8 | 153.8° | 157.2° |
| OR6 | CR1 | NB1 | CB2 | 30.3° | 22.5° |
| OR6 | CR1 | CR2 | H71 | 135.3° | 116.8° |
| CR1 | OR6 | CR4 | H73 | 78.9° | 78.4° |
| CR4 | OR6 | CR1 | CR2 | 12.5° | 26.5° |
| CR4 | OR6 | CR1 | NB1 | 109.4° | 92.9° |
| CR4 | OR6 | CR1 | H70 | 129.4° | 145.9° |
| OR6 | CR4 | CR3 | H72 | 71.7° | 81.2° |
| OR6 | CR4 | CR5 | H74 | 175.5° | 167.3° |
| OR6 | CR4 | CR5 | H75 | 55.9° | 47.3° |
| OP5 | P1 | OP2 | OP3 | 104.9° | 120.0° |
| OP5 | P1 | OP3 | CPR2 | 174.3° | 57.5° |
| OP2 | P1 | OP3 | CPR2 | 67.9° | 177.5° |
| P1 | OP2 | CR3 | H72 | 34.3° | 9.4° |
| OP2 | P1 | OP5 | H89 | 131.0° | 60.0° |
| P1 | OP3 | CPR2 | CPR3 | 118.2° | 126.9° |
| P1 | OP3 | CPR2 | CPR1 | 126.8° | 113.1° |
| OP3 | P1 | OP5 | H89 | 126.7° | 60.0° |
| P1 | OP3 | CPR2 | H1 | 3.9° | 6.9° |
| C50 | C49 | C48 | H48 | 120.1° | 120.1° |
| C50 | C49 | C48 | H49 | 120.1° | 120.0° |
| C49 | C50 | N52 | O51 | 179.8° | 180.0° |
| C50 | C49 | C48 | C13 | 22.3° | 175.5° |
| C50 | C49 | C48 | H46 | 143.5° | 64.5° |
| C50 | C49 | C48 | H47 | 99.0° | 55.5° |
| C50 | C49 | H48 | H49 | 119.8° | 120.0° |
| C49 | C50 | N52 | H84 | 179.8° | 5.0° |
| C49 | C50 | N52 | H85 | 0.2° | 175.0° |
| C48 | C49 | C50 | N52 | 99.5° | 174.9° |
| C48 | C49 | C50 | O51 | 80.7° | 5.1° |
| C49 | C48 | C13 | H46 | 121.2° | 120.1° |
| C49 | C48 | C13 | H47 | 121.3° | 120.0° |
| C49 | C48 | C13 | C12 | 85.9° | 94.1° |
| C49 | C48 | C13 | C14 | 157.7° | 152.8° |
| C49 | C48 | C13 | H10 | 36.4° | 29.6° |
| C49 | C48 | H46 | H47 | 116.0° | 120.0° |
| C48 | C49 | H48 | H49 | 119.8° | 120.0° |
| CR2 | CR1 | NB1 | H70 | 120.5° | 121.0° |
| CR1 | CR2 | OR7 | H71 | 123.5° | 122.5° |
| CR2 | CR1 | NB1 | CB8 | 88.4° | 85.0° |
| CR2 | CR1 | NB1 | CB2 | 87.5° | 95.3° |
| CR1 | CR2 | CR3 | H72 | 79.9° | 97.3° |
| CR1 | CR2 | OR7 | H90 | 68.0° | 61.4° |
| NB1 | CR1 | CR2 | OR7 | 20.6° | 1.3° |
| CR1 | NB1 | CB8 | CB7 | 3.1° | 0.3° |
| CR1 | NB1 | CB8 | CB2 | 176.7° | 179.7° |
| CR1 | NB1 | CB8 | CB9 | 177.0° | 179.7° |
| CR1 | NB1 | CB2 | NB3 | 176.9° | 179.7° |
| CR1 | NB1 | CB2 | H3 | 3.1° | 0.3° |
| NB1 | CR1 | CR2 | H71 | 104.1° | 123.8° |
| N45 | C43 | C42 | C41 | 28.2° | 180.0° |
| N45 | C43 | C42 | H38 | 148.7° | 60.0° |
| N45 | C43 | C42 | H39 | 92.1° | 59.9° |
| C43 | N45 | H82 | H83 | 180.0° | 179.9° |
| C43 | C42 | C41 | H38 | 120.4° | 120.0° |
| C43 | C42 | C41 | H39 | 120.4° | 120.0° |
| C43 | C42 | C41 | C8 | 166.9° | 179.4° |
| C43 | C42 | C41 | H36 | 71.9° | 60.6° |
| C43 | C42 | C41 | H37 | 45.7° | 59.4° |
| C43 | C42 | H38 | H39 | 118.8° | 120.0° |
| C42 | C43 | N45 | H82 | 179.3° | 0.1° |
| C42 | C43 | N45 | H83 | 0.7° | 180.0° |
| OR7 | CR2 | CR1 | H70 | 141.7° | 119.7° |
| OR7 | CR2 | CR3 | H72 | 163.8° | 144.0° |
| N52 | C50 | C49 | H48 | 20.5° | 65.0° |
| N52 | C50 | C49 | H49 | 140.5° | 55.0° |
| C50 | N52 | H84 | H85 | 180.0° | 180.0° |
| O51 | C50 | C49 | H48 | 159.3° | 114.9° |
| O51 | C50 | C49 | H49 | 39.3° | 125.1° |
| O51 | C50 | N52 | H84 | 0.0° | 175.0° |
| O51 | C50 | N52 | H85 | 180.0° | 5.1° |
| CB11 | CB6 | CB7 | CB5 | 179.8° | 180.0° |
| CB11 | CB6 | CB7 | CB8 | 179.7° | 180.0° |
| CB11 | CB6 | CB5 | CB10 | 0.4° | 0.0° |
| CB11 | CB6 | CB5 | CB4 | 179.6° | 180.0° |
| CB11 | CB6 | CB7 | H69 | 0.2° | 0.0° |
| CB6 | CB11 | H95 | H96 | 120.0° | 119.9° |
| CB6 | CB11 | H95 | H97 | 120.0° | 120.1° |
| CB6 | CB11 | H96 | H97 | 120.0° | 120.0° |
| CPR3 | CPR2 | OP3 | CPR1 | 115.0° | 120.0° |
| CPR3 | CPR2 | OP3 | H1 | 122.1° | 120.0° |
| CPR3 | CPR2 | CPR1 | H1 | 123.2° | 120.0° |
| CPR3 | CPR2 | CPR1 | N59 | 148.9° | 170.0° |
| CPR3 | CPR2 | CPR1 | H98 | 27.8° | 50.0° |
| CPR3 | CPR2 | CPR1 | H99 | 90.1° | 70.0° |
| CPR2 | CPR3 | H8 | H11 | 120.0° | 120.0° |
| CPR2 | CPR3 | H8 | H9 | 120.0° | 120.0° |
| CPR2 | CPR3 | H11 | H9 | 120.0° | 120.0° |
| CB6 | CB7 | CB8 | H69 | 180.0° | 180.0° |
| CB6 | CB7 | CB8 | NB1 | 179.8° | 180.0° |
| CB6 | CB7 | CB8 | CB9 | 0.2° | 0.0° |
| CB7 | CB6 | CB5 | CB10 | 179.7° | 180.0° |
| CB7 | CB6 | CB5 | CB4 | 0.3° | 0.0° |
| CB7 | CB6 | CB11 | H95 | 89.9° | 90.0° |
| CB7 | CB6 | CB11 | H96 | 150.1° | 30.0° |
| CB7 | CB6 | CB11 | H97 | 30.1° | 150.0° |
| CB7 | CB8 | NB1 | CB9 | 180.0° | 180.0° |
| CB7 | CB8 | NB1 | CB2 | 179.7° | 180.0° |
| CB8 | CB7 | CB6 | CB5 | 0.1° | 0.0° |
| CB7 | CB8 | CB9 | NB3 | 179.8° | 180.0° |
| CB7 | CB8 | CB9 | CB4 | 0.4° | 0.1° |
| OP3 | CPR2 | CPR1 | H1 | 123.6° | 120.0° |
| OP3 | CPR2 | CPR1 | N59 | 35.7° | 70.0° |
| OP3 | CPR2 | CPR1 | H98 | 85.4° | 170.0° |
| OP3 | CPR2 | CPR1 | H99 | 156.8° | 50.1° |
| OP3 | CPR2 | CPR3 | H8 | 180.0° | 60.0° |
| OP3 | CPR2 | CPR3 | H11 | 60.0° | 180.0° |
| OP3 | CPR2 | CPR3 | H9 | 60.0° | 60.0° |
| CPR2 | CPR1 | N59 | H98 | 121.1° | 120.0° |
| CPR2 | CPR1 | N59 | H99 | 121.1° | 120.0° |
| CPR2 | CPR1 | N59 | C57 | 105.6° | 174.2° |
| CPR2 | CPR1 | N59 | H86 | 74.4° | 5.7° |
| CPR2 | CPR1 | H98 | H99 | 116.7° | 120.0° |
| CPR1 | CPR2 | CPR3 | H8 | 65.9° | 180.0° |
| CPR1 | CPR2 | CPR3 | H11 | 54.1° | 60.0° |
| CPR1 | CPR2 | CPR3 | H9 | 174.1° | 60.0° |
| C47 | C12 | C13 | C48 | 22.1° | 2.7° |
| C47 | C12 | C13 | C11 | 121.9° | 118.0° |
| C47 | C12 | C13 | C46 | 123.1° | 123.7° |
| C47 | C12 | C11 | C46 | 121.8° | 123.6° |
| C47 | C12 | C13 | C14 | 145.1° | 120.7° |
| C47 | C12 | C11 | C10 | 28.0° | 54.4° |
| C47 | C12 | C11 | N23 | 150.5° | 124.8° |
| C47 | C12 | C13 | H10 | 100.2° | 121.1° |
| C47 | C12 | C46 | H40 | 180.0° | 63.6° |
| C47 | C12 | C46 | H41 | 60.0° | 56.4° |
| C47 | C12 | C46 | H42 | 60.0° | 176.4° |
| C12 | C47 | H43 | H44 | 120.0° | 120.0° |
| C12 | C47 | H43 | H45 | 120.0° | 120.0° |
| C12 | C47 | H44 | H45 | 120.0° | 120.0° |
| C48 | C13 | C12 | C14 | 123.0° | 118.0° |
| C48 | C13 | C12 | H10 | 122.3° | 123.8° |
| C48 | C13 | C12 | C11 | 99.8° | 115.2° |
| C48 | C13 | C12 | C46 | 145.2° | 126.5° |
| C48 | C13 | C14 | H10 | 121.2° | 123.4° |
| C48 | C13 | C14 | N23 | 105.9° | 119.8° |
| C48 | C13 | C14 | C15 | 70.9° | 58.4° |
| C13 | C48 | H46 | H47 | 116.0° | 119.9° |
| C13 | C48 | C49 | H48 | 97.8° | 55.4° |
| C13 | C48 | C49 | H49 | 142.4° | 64.6° |
| C42 | C41 | C8 | H36 | 121.2° | 120.0° |
| C42 | C41 | C8 | H37 | 121.2° | 120.0° |
| C42 | C41 | C8 | C9 | 65.2° | 72.0° |
| C42 | C41 | C8 | C7 | 178.0° | 175.6° |
| C42 | C41 | H36 | H37 | 116.3° | 120.0° |
| C41 | C42 | H38 | H39 | 118.8° | 120.0° |
| C42 | C41 | C8 | H65 | 57.9° | 52.1° |
| CB8 | NB1 | CB2 | NB3 | 0.3° | 0.0° |
| NB1 | CB8 | CB9 | NB3 | 0.2° | 0.0° |
| NB1 | CB8 | CB9 | CB4 | 179.6° | 180.0° |
| CB8 | NB1 | CB2 | H3 | 179.7° | 180.0° |
| NB1 | CB8 | CB7 | H69 | 0.3° | 0.0° |
| CB8 | NB1 | CR1 | H70 | 32.1° | 35.9° |
| CB2 | NB1 | CB8 | CB9 | 0.3° | 0.0° |
| NB1 | CB2 | NB3 | H3 | 180.0° | 179.9° |
| NB1 | CB2 | NB3 | CB9 | 0.1° | 0.0° |
| CB2 | NB1 | CR1 | H70 | 152.0° | 143.7° |
| CB6 | CB5 | CB10 | CB4 | 180.0° | 180.0° |
| CB6 | CB5 | CB4 | CB9 | 0.1° | 0.0° |
| CB6 | CB5 | CB4 | H68 | 179.9° | 180.0° |
| CB5 | CB6 | CB7 | H69 | 179.9° | 180.0° |
| CB6 | CB5 | CB10 | H92 | 90.0° | 90.0° |
| CB6 | CB5 | CB10 | H93 | 150.0° | 30.0° |
| CB6 | CB5 | CB10 | H94 | 30.0° | 150.0° |
| CB5 | CB6 | CB11 | H95 | 89.9° | 90.0° |
| CB5 | CB6 | CB11 | H96 | 30.1° | 150.0° |
| CB5 | CB6 | CB11 | H97 | 150.1° | 30.0° |
| CB8 | CB9 | NB3 | CB2 | 0.1° | 0.0° |
| CB8 | CB9 | CB4 | CB5 | 0.2° | 0.1° |
| CB8 | CB9 | NB3 | CB4 | 179.8° | 179.9° |
| CB8 | CB9 | CB4 | H68 | 179.8° | 180.0° |
| CB9 | CB8 | CB7 | H69 | 179.7° | 180.0° |
| CPR1 | N59 | C57 | O58 | 2.3° | 5.4° |
| CPR1 | N59 | C57 | H86 | 180.0° | 179.9° |
| CPR1 | N59 | C57 | C56 | 179.2° | 174.5° |
| N59 | CPR1 | H98 | H99 | 116.6° | 120.0° |
| N59 | CPR1 | CPR2 | H1 | 87.9° | 50.1° |
| C13 | C12 | C11 | C46 | 110.7° | 118.3° |
| C12 | C13 | C14 | H10 | 114.6° | 118.4° |
| C13 | C12 | C11 | C10 | 155.5° | 172.6° |
| C13 | C12 | C11 | N23 | 23.0° | 6.7° |
| C12 | C13 | C14 | N23 | 18.4° | 1.6° |
| C12 | C13 | C14 | C15 | 164.8° | 176.6° |
| C13 | C12 | C46 | H40 | 51.0° | 60.0° |
| C13 | C12 | C46 | H41 | 69.0° | 180.0° |
| C13 | C12 | C46 | H42 | 171.0° | 60.0° |
| C13 | C12 | C47 | H43 | 180.0° | 62.5° |
| C13 | C12 | C47 | H44 | 60.0° | 177.5° |
| C13 | C12 | C47 | H45 | 60.0° | 57.5° |
| C12 | C13 | C48 | H46 | 35.4° | 145.8° |
| C12 | C13 | C48 | H47 | 152.9° | 25.9° |
| C11 | C12 | C13 | C14 | 23.2° | 2.7° |
| C12 | C11 | C10 | N23 | 178.3° | 179.1° |
| C12 | C11 | C10 | C9 | 166.6° | 176.0° |
| C12 | C11 | N23 | C14 | 12.0° | 8.1° |
| C12 | C11 | N23 | CO1 | 175.9° | 172.6° |
| C12 | C11 | C10 | H7 | 13.4° | 4.7° |
| C11 | C12 | C13 | H10 | 137.9° | 120.9° |
| C11 | C12 | C46 | H40 | 57.7° | 173.1° |
| C11 | C12 | C46 | H41 | 177.6° | 66.9° |
| C11 | C12 | C46 | H42 | 62.3° | 53.1° |
| C11 | C12 | C47 | H43 | 62.8° | 50.5° |
| C11 | C12 | C47 | H44 | 177.2° | 69.5° |
| C11 | C12 | C47 | H45 | 57.2° | 170.4° |
| C46 | C12 | C13 | C14 | 91.8° | 115.6° |
| C46 | C12 | C11 | C10 | 93.8° | 69.2° |
| C46 | C12 | C11 | N23 | 87.7° | 111.6° |
| C46 | C12 | C13 | H10 | 22.9° | 2.6° |
| C12 | C46 | H40 | H41 | 120.0° | 120.0° |
| C12 | C46 | H40 | H42 | 120.0° | 120.0° |
| C12 | C46 | H41 | H42 | 120.0° | 120.1° |
| C46 | C12 | C47 | H43 | 59.4° | 174.0° |
| C46 | C12 | C47 | H44 | 60.6° | 54.0° |
| C46 | C12 | C47 | H45 | 179.4° | 66.1° |
| CB2 | NB3 | CB9 | CB4 | 179.8° | 179.9° |
| C13 | C14 | N23 | C11 | 4.7° | 6.1° |
| C13 | C14 | N23 | C15 | 176.7° | 177.9° |
| C13 | C14 | N23 | CO1 | 166.8° | 174.7° |
| C13 | C14 | C15 | C53 | 16.5° | 3.9° |
| C13 | C14 | C15 | C16 | 175.1° | 175.7° |
| C14 | C13 | C48 | H46 | 81.0° | 32.8° |
| C14 | C13 | C48 | H47 | 36.5° | 87.2° |
| CB10 | CB5 | CB4 | CB9 | 179.9° | 180.0° |
| CB10 | CB5 | CB4 | H68 | 0.1° | 0.0° |
| CB5 | CB10 | H92 | H93 | 120.0° | 120.0° |
| CB5 | CB10 | H92 | H94 | 120.0° | 120.0° |
| CB5 | CB10 | H93 | H94 | 120.0° | 120.1° |
| CB5 | CB4 | CB9 | NB3 | 180.0° | 180.0° |
| CB5 | CB4 | CB9 | H68 | 180.0° | 180.0° |
| CB4 | CB5 | CB10 | H92 | 90.0° | 90.0° |
| CB4 | CB5 | CB10 | H93 | 30.0° | 150.0° |
| CB4 | CB5 | CB10 | H94 | 150.0° | 30.0° |
| C41 | C8 | C9 | C10 | 96.5° | 66.1° |
| C41 | C8 | C9 | C7 | 118.1° | 117.8° |
| C41 | C8 | C9 | H65 | 122.8° | 124.2° |
| C41 | C8 | C9 | N22 | 95.3° | 116.8° |
| C41 | C8 | C7 | H65 | 124.0° | 123.8° |
| C41 | C8 | C7 | C36 | 36.2° | 3.4° |
| C41 | C8 | C7 | C6 | 91.2° | 115.2° |
| C41 | C8 | C7 | C37 | 159.7° | 127.2° |
| C8 | C41 | H36 | H37 | 116.2° | 120.0° |
| C8 | C41 | C42 | H38 | 46.5° | 60.6° |
| C8 | C41 | C42 | H39 | 72.7° | 59.4° |
| O58 | C57 | N59 | C56 | 176.9° | 179.9° |
| O58 | C57 | C56 | C55 | 74.3° | 8.3° |
| O58 | C57 | C56 | H59 | 45.1° | 128.2° |
| O58 | C57 | C56 | H60 | 166.2° | 111.8° |
| O58 | C57 | N59 | H86 | 177.7° | 174.5° |
| CB9 | NB3 | CB2 | H3 | 179.9° | 180.0° |
| NB3 | CB9 | CB4 | H68 | 0.0° | 0.1° |
| C11 | C10 | C9 | H7 | 180.0° | 179.3° |
| C11 | C10 | C9 | C8 | 158.1° | 177.8° |
| C11 | C10 | C9 | N22 | 8.3° | 5.5° |
| C10 | C11 | N23 | C14 | 166.4° | 171.1° |
| C10 | C11 | N23 | CO1 | 5.6° | 8.2° |
| C9 | C10 | C11 | N23 | 15.1° | 3.1° |
| C10 | C9 | C8 | N22 | 168.2° | 177.1° |
| C10 | C9 | C8 | C7 | 145.4° | 176.1° |
| C10 | C9 | N22 | CO1 | 6.3° | 3.8° |
| C10 | C9 | N22 | C6 | 159.3° | 178.4° |
| C10 | C9 | C8 | H65 | 26.3° | 58.1° |
| C11 | N23 | C14 | CO1 | 171.5° | 179.2° |
| C11 | N23 | C14 | C15 | 178.6° | 171.9° |
| C11 | N23 | CO1 | N22 | 5.8° | 13.3° |
| C11 | N23 | CO1 | N24 | 178.1° | 176.2° |
| C11 | N23 | CO1 | N21 | 173.7° | 107.1° |
| C11 | N23 | CO1 | C1L | 88.7° | 86.4° |
| N23 | C11 | C10 | H7 | 164.9° | 176.2° |
| N59 | C57 | C56 | C55 | 102.5° | 171.8° |
| N59 | C57 | C56 | H59 | 138.0° | 51.9° |
| N59 | C57 | C56 | H60 | 16.9° | 68.1° |
| C57 | N59 | CPR1 | H98 | 133.3° | 65.8° |
| C57 | N59 | CPR1 | H99 | 15.4° | 54.2° |
| C57 | C56 | C55 | H59 | 119.4° | 120.0° |
| C57 | C56 | C55 | H60 | 119.4° | 120.1° |
| C57 | C56 | C55 | C17 | 160.9° | 176.8° |
| C57 | C56 | C55 | H57 | 78.2° | 56.9° |
| C57 | C56 | C55 | H58 | 40.0° | 63.2° |
| C57 | C56 | H59 | H60 | 121.6° | 120.0° |
| C56 | C57 | N59 | H86 | 0.8° | 5.5° |
| C9 | C8 | C7 | H65 | 119.4° | 118.3° |
| C8 | C9 | N22 | CO1 | 174.2° | 173.1° |
| C8 | C9 | N22 | C6 | 8.6° | 1.6° |
| C9 | C8 | C7 | C36 | 152.9° | 121.4° |
| C9 | C8 | C7 | C6 | 25.5° | 2.8° |
| C9 | C8 | C7 | C37 | 83.7° | 114.8° |
| C8 | C9 | C10 | H7 | 21.9° | 2.9° |
| C9 | C8 | C41 | H36 | 173.6° | 168.1° |
| C9 | C8 | C41 | H37 | 56.0° | 48.0° |
| N22 | C9 | C8 | C7 | 22.8° | 1.0° |
| C9 | N22 | CO1 | N23 | 11.4° | 11.2° |
| C9 | N22 | CO1 | C6 | 163.4° | 173.7° |
| C9 | N22 | CO1 | N24 | 159.6° | 113.1° |
| C9 | N22 | CO1 | N21 | 168.5° | 172.3° |
| C9 | N22 | CO1 | C1L | 98.6° | 87.3° |
| C9 | N22 | C6 | C7 | 9.5° | 3.6° |
| C9 | N22 | C6 | C5 | 179.2° | 179.6° |
| N22 | C9 | C10 | H7 | 171.7° | 173.7° |
| N22 | C9 | C8 | H65 | 141.9° | 119.0° |
| N23 | C14 | C15 | C53 | 167.3° | 173.9° |
| N23 | C14 | C15 | C16 | 1.1° | 6.4° |
| C14 | N23 | CO1 | N22 | 176.4° | 165.8° |
| C14 | N23 | CO1 | N24 | 7.4° | 3.0° |
| C14 | N23 | CO1 | N21 | 3.0° | 72.0° |
| C14 | N23 | CO1 | C1L | 100.7° | 94.4° |
| N23 | C14 | C13 | H10 | 133.0° | 116.7° |
| C15 | C14 | N23 | CO1 | 9.9° | 7.4° |
| C14 | C15 | C53 | C16 | 168.3° | 179.7° |
| C14 | C15 | C16 | N24 | 8.4° | 1.8° |
| C14 | C15 | C16 | C17 | 175.7° | 175.2° |
| C15 | C14 | C13 | H10 | 50.3° | 65.0° |
| C14 | C15 | C53 | H51 | 180.0° | 7.5° |
| C14 | C15 | C53 | H52 | 60.0° | 127.5° |
| C14 | C15 | C53 | H53 | 60.0° | 112.5° |
| C8 | C7 | C6 | N22 | 22.5° | 4.1° |
| C8 | C7 | C36 | C6 | 113.7° | 113.9° |
| C8 | C7 | C36 | C37 | 122.0° | 123.3° |
| C8 | C7 | C6 | C37 | 114.2° | 117.6° |
| C8 | C7 | C6 | C5 | 167.0° | 178.6° |
| C8 | C7 | C37 | C38 | 63.1° | 55.0° |
| C8 | C7 | C36 | H31 | 180.0° | 178.1° |
| C8 | C7 | C36 | H32 | 60.0° | 58.2° |
| C8 | C7 | C36 | H33 | 60.0° | 61.8° |
| C8 | C7 | C37 | H34 | 176.1° | 65.0° |
| C8 | C7 | C37 | H35 | 57.6° | 174.9° |
| C7 | C8 | C41 | H36 | 60.9° | 55.6° |
| C7 | C8 | C41 | H37 | 56.8° | 64.5° |
| N23 | CO1 | N22 | N24 | 148.1° | 101.9° |
| N23 | CO1 | N22 | N21 | 179.9° | 161.1° |
| N23 | CO1 | N22 | C1L | 87.2° | 98.6° |
| N23 | CO1 | N22 | C6 | 151.9° | 175.1° |
| N23 | CO1 | N24 | N21 | 179.4° | 162.4° |
| N23 | CO1 | N24 | C1L | 88.0° | 96.9° |
| N23 | CO1 | N21 | C1L | 97.4° | 166.3° |
| N23 | CO1 | N24 | C16 | 2.0° | 1.0° |
| N23 | CO1 | N24 | C19 | 166.3° | 175.2° |
| N23 | CO1 | N21 | C1 | 9.4° | 59.8° |
| N23 | CO1 | N21 | C4 | 154.4° | 117.7° |
| N23 | CO1 | C1L | C2L | 73.0° | 135.0° |
| C56 | C55 | C17 | H57 | 120.9° | 119.9° |
| C56 | C55 | C17 | H58 | 120.9° | 120.0° |
| C56 | C55 | C17 | C16 | 37.9° | 68.4° |
| C56 | C55 | C17 | C18 | 75.4° | 45.9° |
| C56 | C55 | C17 | C54 | 167.0° | 169.6° |
| C56 | C55 | H57 | H58 | 117.2° | 120.0° |
| C55 | C56 | H59 | H60 | 121.7° | 120.0° |
| C53 | C15 | C16 | N24 | 176.1° | 178.5° |
| C53 | C15 | C16 | C17 | 16.6° | 4.4° |
| C15 | C53 | H51 | H52 | 120.0° | 120.0° |
| C15 | C53 | H51 | H53 | 120.0° | 120.0° |
| C15 | C53 | H52 | H53 | 120.0° | 120.0° |
| C15 | C16 | N24 | CO1 | 9.6° | 1.5° |
| C15 | C16 | C17 | C55 | 44.0° | 49.5° |
| C15 | C16 | N24 | C17 | 169.4° | 177.6° |
| C15 | C16 | N24 | C19 | 174.3° | 174.7° |
| C15 | C16 | C17 | C18 | 160.7° | 168.3° |
| C15 | C16 | C17 | C54 | 83.2° | 73.2° |
| C16 | C15 | C53 | H51 | 11.7° | 172.2° |
| C16 | C15 | C53 | H52 | 131.7° | 52.1° |
| C16 | C15 | C53 | H53 | 108.3° | 67.8° |
| O39 | C38 | C37 | C7 | 68.6° | 5.3° |
| O39 | C38 | C37 | N40 | 178.7° | 179.9° |
| O39 | C38 | C37 | H34 | 170.6° | 125.2° |
| O39 | C38 | C37 | H35 | 52.1° | 114.7° |
| O39 | C38 | N40 | H80 | 0.0° | 180.0° |
| O39 | C38 | N40 | H81 | 180.0° | 0.1° |
| N22 | CO1 | N24 | N21 | 32.1° | 59.0° |
| N22 | CO1 | N24 | C1L | 60.4° | 159.6° |
| N22 | CO1 | N21 | C1L | 83.2° | 97.7° |
| CO1 | N22 | C6 | C7 | 155.6° | 170.8° |
| N22 | CO1 | N24 | C16 | 146.4° | 102.5° |
| CO1 | N22 | C6 | C5 | 15.7° | 6.0° |
| N22 | CO1 | N24 | C19 | 17.9° | 81.4° |
| N22 | CO1 | N21 | C1 | 170.1° | 155.7° |
| N22 | CO1 | N21 | C4 | 26.1° | 21.7° |
| N22 | CO1 | C1L | C2L | 24.8° | 126.5° |
| C6 | N22 | CO1 | N24 | 3.8° | 73.2° |
| C6 | N22 | CO1 | N21 | 28.1° | 14.0° |
| C6 | N22 | CO1 | C1L | 64.8° | 86.3° |
| N22 | C6 | C7 | C36 | 139.9° | 123.1° |
| N22 | C6 | C7 | C5 | 170.5° | 177.3° |
| N22 | C6 | C7 | C37 | 91.8° | 113.5° |
| N22 | C6 | C5 | C4 | 9.6° | 5.7° |
| N22 | C6 | C5 | C35 | 175.8° | 176.0° |
| N24 | CO1 | N21 | C1L | 92.9° | 97.3° |
| CO1 | N24 | C16 | C19 | 164.7° | 176.2° |
| CO1 | N24 | C16 | C17 | 179.1° | 179.0° |
| N24 | CO1 | N21 | C1 | 13.8° | 9.3° |
| N24 | CO1 | N21 | C4 | 150.0° | 173.3° |
| N24 | CO1 | C1L | C2L | 161.6° | 47.4° |
| CO1 | N24 | C19 | C1 | 36.6° | 46.2° |
| CO1 | N24 | C19 | C18 | 158.4° | 163.2° |
| CO1 | N24 | C19 | H15 | 83.3° | 74.9° |
| N21 | CO1 | N24 | C16 | 178.5° | 161.4° |
| CO1 | N21 | C1 | C20 | 78.6° | 83.6° |
| N21 | CO1 | N24 | C19 | 14.2° | 22.4° |
| CO1 | N21 | C1 | C4 | 166.3° | 178.3° |
| N21 | CO1 | C1L | C2L | 114.1° | 40.6° |
| CO1 | N21 | C4 | C5 | 10.8° | 16.2° |
| CO1 | N21 | C1 | C19 | 36.2° | 36.5° |
| CO1 | N21 | C1 | C2 | 159.9° | 154.5° |
| CO1 | N21 | C4 | C3 | 179.9° | 167.3° |
| C1L | CO1 | N24 | C16 | 86.0° | 97.9° |
| C1L | CO1 | N24 | C19 | 78.3° | 78.2° |
| C1L | CO1 | N21 | C1 | 106.7° | 106.6° |
| C1L | CO1 | N21 | C4 | 57.1° | 76.0° |
| CO1 | C1L | C2L | C3L | 37.8° | 164.1° |
| C36 | C7 | C6 | C37 | 128.4° | 123.4° |
| C36 | C7 | C6 | C5 | 49.6° | 59.5° |
| C36 | C7 | C37 | C38 | 57.0° | 68.9° |
| C7 | C36 | H31 | H32 | 120.0° | 120.0° |
| C7 | C36 | H31 | H33 | 120.0° | 120.1° |
| C7 | C36 | H32 | H33 | 120.0° | 120.0° |
| C36 | C7 | C37 | H34 | 63.8° | 171.1° |
| C36 | C7 | C37 | H35 | 177.7° | 51.0° |
| C36 | C7 | C8 | H65 | 87.8° | 120.3° |
| C6 | C7 | C37 | C38 | 169.7° | 168.0° |
| C7 | C6 | C5 | C4 | 179.0° | 177.6° |
| C7 | C6 | C5 | C35 | 14.7° | 0.7° |
| C6 | C7 | C36 | H31 | 66.3° | 68.0° |
| C6 | C7 | C36 | H32 | 173.8° | 172.0° |
| C6 | C7 | C36 | H33 | 53.8° | 52.0° |
| C6 | C7 | C37 | H34 | 69.6° | 48.0° |
| C6 | C7 | C37 | H35 | 49.0° | 72.1° |
| C6 | C7 | C8 | H65 | 144.8° | 121.0° |
| C37 | C7 | C6 | C5 | 78.8° | 63.8° |
| C7 | C37 | C38 | H34 | 120.8° | 120.0° |
| C7 | C37 | C38 | H35 | 120.8° | 120.0° |
| C7 | C37 | C38 | N40 | 112.6° | 174.8° |
| C37 | C7 | C36 | H31 | 58.0° | 54.8° |
| C37 | C7 | C36 | H32 | 61.9° | 65.1° |
| C37 | C7 | C36 | H33 | 178.1° | 174.9° |
| C7 | C37 | H34 | H35 | 117.7° | 120.0° |
| C37 | C7 | C8 | H65 | 35.7° | 3.4° |
| C55 | C17 | C16 | N24 | 124.4° | 133.3° |
| C55 | C17 | C16 | C18 | 116.7° | 118.7° |
| C55 | C17 | C16 | C54 | 127.2° | 122.8° |
| C55 | C17 | C18 | C54 | 117.3° | 123.7° |
| C55 | C17 | C18 | C19 | 151.0° | 142.6° |
| C55 | C17 | C18 | C60 | 76.3° | 100.6° |
| C55 | C17 | C18 | H14 | 40.7° | 24.6° |
| C55 | C17 | C54 | H54 | 180.0° | 179.0° |
| C55 | C17 | C54 | H55 | 60.0° | 58.9° |
| C55 | C17 | C54 | H56 | 60.0° | 61.0° |
| C17 | C55 | H57 | H58 | 117.2° | 120.0° |
| C17 | C55 | C56 | H59 | 41.4° | 63.2° |
| C17 | C55 | C56 | H60 | 79.7° | 56.7° |
| N24 | C16 | C17 | C18 | 7.7° | 14.5° |
| N24 | C16 | C17 | C54 | 108.5° | 104.0° |
| C16 | N24 | C19 | C1 | 155.2° | 136.3° |
| C16 | N24 | C19 | C18 | 33.4° | 19.4° |
| C16 | N24 | C19 | H15 | 84.9° | 102.5° |
| C17 | C16 | N24 | C19 | 16.2° | 2.8° |
| C16 | C17 | C18 | C54 | 118.7° | 117.7° |
| C16 | C17 | C18 | C19 | 27.0° | 24.0° |
| C16 | C17 | C18 | C60 | 159.7° | 140.8° |
| C16 | C17 | C18 | H14 | 83.3° | 94.0° |
| C16 | C17 | C54 | H54 | 48.0° | 58.5° |
| C16 | C17 | C54 | H55 | 168.1° | 178.6° |
| C16 | C17 | C54 | H56 | 71.9° | 61.5° |
| C16 | C17 | C55 | H57 | 158.8° | 51.5° |
| C16 | C17 | C55 | H58 | 83.0° | 171.5° |
| C6 | C5 | C4 | N21 | 13.2° | 2.0° |
| C6 | C5 | C4 | C35 | 167.2° | 178.3° |
| C6 | C5 | C4 | C3 | 154.4° | 173.7° |
| C6 | C5 | C35 | H28 | 180.0° | 175.1° |
| C6 | C5 | C35 | H29 | 60.0° | 55.1° |
| C6 | C5 | C35 | H30 | 60.0° | 64.9° |
| C20 | C1 | C19 | N24 | 75.6° | 69.7° |
| C20 | C1 | N21 | C19 | 114.8° | 120.1° |
| C20 | C1 | N21 | C2 | 121.5° | 121.9° |
| C20 | C1 | N21 | C4 | 115.1° | 94.7° |
| C20 | C1 | C19 | C2 | 128.9° | 125.3° |
| C20 | C1 | C19 | C18 | 35.9° | 44.1° |
| C20 | C1 | C2 | C3 | 96.6° | 94.4° |
| C20 | C1 | C2 | C25 | 26.7° | 23.5° |
| C20 | C1 | C2 | C26 | 149.2° | 147.8° |
| C20 | C1 | C19 | H15 | 163.9° | 170.4° |
| C1 | C20 | H16 | H17 | 120.0° | 120.0° |
| C1 | C20 | H16 | H18 | 120.0° | 119.9° |
| C1 | C20 | H17 | H18 | 120.0° | 120.0° |
| N24 | C19 | C1 | N21 | 43.5° | 50.6° |
| N24 | C19 | C18 | C17 | 36.2° | 26.6° |
| N24 | C19 | C1 | C18 | 111.5° | 113.7° |
| N24 | C19 | C1 | H15 | 120.5° | 120.0° |
| N24 | C19 | C1 | C2 | 155.5° | 165.0° |
| N24 | C19 | C18 | H15 | 118.8° | 122.1° |
| N24 | C19 | C18 | C60 | 168.9° | 143.2° |
| N24 | C19 | C18 | H14 | 74.1° | 91.7° |
| C38 | C37 | H34 | H35 | 117.7° | 120.0° |
| C37 | C38 | N40 | H80 | 178.8° | 0.0° |
| C37 | C38 | N40 | H81 | 1.2° | 180.0° |
| N40 | C38 | C37 | H34 | 8.1° | 54.8° |
| N40 | C38 | C37 | H35 | 126.6° | 65.2° |
| C38 | N40 | H80 | H81 | 180.0° | 180.0° |
| C1 | N21 | C4 | C5 | 174.9° | 161.3° |
| N21 | C1 | C19 | C2 | 112.0° | 114.3° |
| N21 | C1 | C19 | C18 | 155.0° | 164.4° |
| C1 | N21 | C4 | C3 | 16.1° | 15.2° |
| N21 | C1 | C2 | C3 | 24.5° | 27.7° |
| N21 | C1 | C2 | C25 | 147.8° | 145.6° |
| N21 | C1 | C2 | C26 | 89.6° | 90.1° |
| N21 | C1 | C19 | H15 | 76.9° | 69.3° |
| N21 | C1 | C20 | H16 | 180.0° | 174.2° |
| N21 | C1 | C20 | H17 | 60.0° | 65.8° |
| N21 | C1 | C20 | H18 | 60.0° | 54.3° |
| N21 | C4 | C5 | C3 | 167.6° | 175.7° |
| N21 | C4 | C5 | C35 | 179.6° | 179.7° |
| C4 | N21 | C1 | C19 | 130.1° | 145.2° |
| C4 | N21 | C1 | C2 | 6.4° | 27.3° |
| N21 | C4 | C3 | C30 | 95.7° | 115.7° |
| N21 | C4 | C3 | C2 | 31.0° | 2.8° |
| N21 | C4 | C3 | H2 | 144.2° | 121.3° |
| C17 | C18 | C19 | C1 | 149.5° | 137.2° |
| C17 | C18 | C19 | C60 | 132.6° | 116.6° |
| C17 | C18 | C19 | H14 | 110.3° | 118.2° |
| C17 | C18 | C60 | H14 | 117.1° | 125.0° |
| C17 | C18 | C60 | C61 | 116.2° | 65.5° |
| C17 | C18 | C19 | H15 | 82.6° | 95.5° |
| C18 | C17 | C54 | H54 | 63.4° | 55.4° |
| C18 | C17 | C54 | H55 | 56.6° | 64.7° |
| C18 | C17 | C54 | H56 | 176.6° | 175.4° |
| C18 | C17 | C55 | H57 | 45.5° | 165.8° |
| C18 | C17 | C55 | H58 | 163.7° | 74.2° |
| C17 | C18 | C60 | H62 | 3.8° | 54.5° |
| C17 | C18 | C60 | H63 | 123.7° | 174.5° |
| C54 | C17 | C18 | C19 | 91.7° | 93.7° |
| C54 | C17 | C18 | C60 | 41.0° | 23.1° |
| C54 | C17 | C18 | H14 | 158.0° | 148.3° |
| C17 | C54 | H54 | H55 | 120.0° | 120.1° |
| C17 | C54 | H54 | H56 | 120.0° | 120.0° |
| C17 | C54 | H55 | H56 | 120.0° | 120.0° |
| C54 | C17 | C55 | H57 | 72.1° | 70.5° |
| C54 | C17 | C55 | H58 | 46.1° | 49.5° |
| O33 | C32 | C31 | C30 | 53.5° | 0.0° |
| O33 | C32 | N34 | C31 | 179.8° | 179.9° |
| O33 | C32 | C31 | H26 | 174.0° | 120.0° |
| O33 | C32 | C31 | H27 | 67.0° | 120.0° |
| O33 | C32 | N34 | H78 | 0.0° | 180.0° |
| O33 | C32 | N34 | H79 | 180.0° | 0.1° |
| C1L | C2L | C3L | C4L | 9.8° | 69.7° |
| C1L | C2L | C3L | C8L | 169.1° | 110.5° |
| O62 | C61 | C60 | C18 | 16.1° | 8.0° |
| O62 | C61 | C60 | N63 | 179.7° | 180.0° |
| O62 | C61 | C60 | H62 | 104.0° | 128.0° |
| O62 | C61 | C60 | H63 | 136.1° | 112.0° |
| O62 | C61 | N63 | H87 | 0.0° | 180.0° |
| O62 | C61 | N63 | H88 | 180.0° | 0.0° |
| C5L | C4L | C3L | H50 | 180.0° | 179.9° |
| C4L | C5L | C6L | H61 | 180.0° | 179.9° |
| C5L | C4L | C3L | C2L | 179.4° | 179.9° |
| C5L | C4L | C3L | C8L | 0.4° | 0.2° |
| C4L | C5L | C6L | O01 | 179.2° | 179.9° |
| C4L | C5L | C6L | C7L | 0.3° | 0.1° |
| C3L | C4L | C5L | C6L | 0.2° | 0.1° |
| C4L | C3L | C2L | C8L | 178.9° | 179.7° |
| C4L | C3L | C8L | C7L | 0.0° | 0.5° |
| C3L | C4L | C5L | H61 | 179.8° | 180.0° |
| C4L | C3L | C8L | H66 | 179.9° | 179.8° |
| C5 | C4 | C3 | C30 | 73.4° | 60.2° |
| C5 | C4 | C3 | C2 | 159.9° | 178.6° |
| C5 | C4 | C3 | H2 | 46.7° | 62.8° |
| C4 | C5 | C35 | H28 | 12.9° | 6.8° |
| C4 | C5 | C35 | H29 | 133.0° | 126.8° |
| C4 | C5 | C35 | H30 | 107.0° | 113.2° |
| C35 | C5 | C4 | C3 | 12.9° | 4.6° |
| C5 | C35 | H28 | H29 | 120.0° | 120.0° |
| C5 | C35 | H28 | H30 | 120.0° | 120.0° |
| C5 | C35 | H29 | H30 | 120.0° | 120.0° |
| C1 | C19 | C18 | H15 | 128.0° | 127.3° |
| C1 | C19 | C18 | C60 | 77.9° | 106.2° |
| C19 | C1 | C2 | C3 | 137.6° | 140.2° |
| C19 | C1 | C2 | C25 | 99.0° | 101.9° |
| C19 | C1 | C2 | C26 | 23.5° | 22.4° |
| C1 | C19 | C18 | H14 | 39.2° | 19.0° |
| C19 | C1 | C20 | H16 | 66.7° | 58.8° |
| C19 | C1 | C20 | H17 | 173.2° | 178.8° |
| C19 | C1 | C20 | H18 | 53.3° | 61.1° |
| C2 | C1 | C19 | C18 | 93.0° | 81.3° |
| C1 | C2 | C3 | C4 | 32.3° | 18.3° |
| C1 | C2 | C3 | C30 | 89.9° | 100.4° |
| C1 | C2 | C3 | C25 | 121.0° | 118.2° |
| C1 | C2 | C3 | C26 | 116.6° | 118.4° |
| C1 | C2 | C25 | C26 | 123.1° | 124.4° |
| C1 | C2 | C26 | C27 | 157.0° | 178.3° |
| C1 | C2 | C3 | H2 | 146.1° | 137.0° |
| C2 | C1 | C19 | H15 | 35.0° | 45.0° |
| C2 | C1 | C20 | H16 | 65.2° | 66.7° |
| C2 | C1 | C20 | H17 | 54.8° | 53.3° |
| C2 | C1 | C20 | H18 | 174.8° | 173.4° |
| C1 | C2 | C25 | H19 | 180.0° | 48.1° |
| C1 | C2 | C25 | H20 | 60.0° | 71.9° |
| C1 | C2 | C25 | H21 | 60.0° | 168.1° |
| C1 | C2 | C26 | H22 | 82.5° | 61.7° |
| C1 | C2 | C26 | H23 | 36.5° | 58.3° |
| C19 | C18 | C60 | H14 | 117.2° | 124.8° |
| C19 | C18 | C60 | C61 | 118.1° | 175.8° |
| C19 | C18 | C60 | H62 | 121.8° | 55.8° |
| C19 | C18 | C60 | H63 | 2.0° | 64.2° |
| C18 | C60 | C61 | H62 | 120.1° | 120.0° |
| C18 | C60 | C61 | H63 | 120.0° | 120.0° |
| C18 | C60 | C61 | N63 | 164.2° | 172.0° |
| C60 | C18 | C19 | H15 | 50.1° | 21.1° |
| C18 | C60 | H62 | H63 | 119.8° | 120.0° |
| C4 | C3 | C30 | C2 | 116.1° | 114.7° |
| C4 | C3 | C30 | H2 | 120.2° | 122.9° |
| C4 | C3 | C30 | C31 | 154.1° | 71.6° |
| C4 | C3 | C2 | H2 | 113.8° | 118.7° |
| C4 | C3 | C2 | C25 | 153.3° | 136.5° |
| C4 | C3 | C2 | C26 | 84.2° | 100.1° |
| C4 | C3 | C30 | H24 | 33.1° | 48.3° |
| C4 | C3 | C30 | H25 | 84.9° | 168.4° |
| C5L | C6L | O01 | C7L | 179.5° | 179.9° |
| C5L | C6L | O01 | C01 | 144.3° | 179.9° |
| C5L | C6L | C7L | C8L | 0.6° | 0.2° |
| C6L | C5L | C4L | H50 | 179.8° | 180.0° |
| C5L | C6L | C7L | H64 | 179.4° | 180.0° |
| C3 | C30 | C31 | H24 | 121.0° | 120.0° |
| C3 | C30 | C31 | H25 | 121.0° | 120.0° |
| C3 | C30 | C31 | C32 | 174.1° | 171.7° |
| C30 | C3 | C2 | H2 | 124.0° | 122.6° |
| C30 | C3 | C2 | C25 | 31.1° | 17.9° |
| C30 | C3 | C2 | C26 | 153.5° | 141.3° |
| C3 | C30 | H24 | H25 | 116.7° | 120.1° |
| C3 | C30 | C31 | H26 | 65.4° | 51.7° |
| C3 | C30 | C31 | H27 | 53.6° | 68.4° |
| C30 | C31 | C32 | N34 | 126.3° | 180.0° |
| C30 | C31 | C32 | H26 | 120.5° | 120.0° |
| C30 | C31 | C32 | H27 | 120.5° | 120.0° |
| C31 | C30 | C3 | C2 | 89.8° | 173.7° |
| C31 | C30 | C3 | H2 | 33.9° | 51.3° |
| C31 | C30 | H24 | H25 | 116.8° | 120.0° |
| C30 | C31 | H26 | H27 | 118.5° | 120.1° |
| N34 | C32 | C31 | H26 | 5.8° | 60.0° |
| N34 | C32 | C31 | H27 | 113.2° | 60.0° |
| C32 | N34 | H78 | H79 | 180.0° | 180.0° |
| C32 | C31 | C30 | H24 | 53.1° | 68.4° |
| C32 | C31 | C30 | H25 | 64.8° | 51.7° |
| C32 | C31 | H26 | H27 | 118.4° | 120.0° |
| C31 | C32 | N34 | H78 | 179.8° | 0.1° |
| C31 | C32 | N34 | H79 | 0.2° | 180.0° |
| C2L | C3L | C8L | C7L | 178.9° | 179.7° |
| C2L | C3L | C4L | H50 | 0.6° | 0.0° |
| C2L | C3L | C8L | H66 | 1.1° | 0.0° |
| C3L | C8L | C7L | C6L | 0.5° | 0.6° |
| C3L | C8L | C7L | H66 | 180.0° | 179.7° |
| C8L | C3L | C4L | H50 | 179.6° | 179.7° |
| C3L | C8L | C7L | H64 | 179.6° | 179.6° |
| C61 | C60 | C18 | H14 | 0.9° | 59.5° |
| C61 | C60 | H62 | H63 | 119.9° | 120.1° |
| C60 | C61 | N63 | H87 | 179.7° | 0.0° |
| C60 | C61 | N63 | H88 | 0.3° | 180.0° |
| N63 | C61 | C60 | H62 | 75.7° | 52.0° |
| N63 | C61 | C60 | H63 | 44.2° | 68.0° |
| C61 | N63 | H87 | H88 | 180.0° | 180.0° |
| C3 | C2 | C25 | C26 | 121.2° | 123.1° |
| C3 | C2 | C26 | C27 | 46.2° | 65.8° |
| C3 | C2 | C25 | H19 | 64.2° | 64.4° |
| C3 | C2 | C25 | H20 | 55.7° | 175.6° |
| C3 | C2 | C25 | H21 | 175.7° | 55.6° |
| C3 | C2 | C26 | H22 | 166.8° | 174.2° |
| C3 | C2 | C26 | H23 | 74.3° | 54.2° |
| C2 | C3 | C30 | H24 | 149.2° | 66.3° |
| C2 | C3 | C30 | H25 | 31.2° | 53.7° |
| C25 | C2 | C26 | C27 | 79.4° | 57.3° |
| C25 | C2 | C3 | H2 | 92.9° | 104.8° |
| C2 | C25 | H19 | H20 | 120.0° | 120.0° |
| C2 | C25 | H19 | H21 | 120.0° | 120.0° |
| C2 | C25 | H20 | H21 | 120.0° | 120.0° |
| C25 | C2 | C26 | H22 | 41.1° | 62.6° |
| C25 | C2 | C26 | H23 | 160.0° | 177.3° |
| C2 | C26 | C27 | H22 | 120.5° | 120.0° |
| C2 | C26 | C27 | H23 | 120.5° | 120.0° |
| C2 | C26 | C27 | O28 | 118.4° | 0.0° |
| C2 | C26 | C27 | N29 | 60.8° | 180.0° |
| C26 | C2 | C3 | H2 | 29.5° | 18.6° |
| C26 | C2 | C25 | H19 | 56.9° | 172.5° |
| C26 | C2 | C25 | H20 | 176.9° | 52.5° |
| C26 | C2 | C25 | H21 | 63.1° | 67.5° |
| C2 | C26 | H22 | H23 | 118.4° | 120.0° |
| O01 | C6L | C7L | C8L | 178.8° | 179.7° |
| C6L | O01 | C01 | H4 | 180.0° | 60.0° |
| C6L | O01 | C01 | H5 | 60.0° | 60.1° |
| C6L | O01 | C01 | H6 | 60.0° | 180.0° |
| O01 | C6L | C5L | H61 | 0.8° | 0.1° |
| O01 | C6L | C7L | H64 | 1.1° | 0.1° |
| C7L | C6L | O01 | C01 | 36.2° | 0.0° |
| C6L | C7L | C8L | H64 | 180.0° | 179.8° |
| C7L | C6L | C5L | H61 | 179.7° | 180.0° |
| C6L | C7L | C8L | H66 | 179.5° | 179.8° |
| O01 | C01 | H4 | H5 | 120.0° | 120.1° |
| O01 | C01 | H4 | H6 | 120.0° | 120.0° |
| O01 | C01 | H5 | H6 | 120.0° | 119.9° |
| C26 | C27 | O28 | N29 | 179.2° | 180.0° |
| C27 | C26 | H22 | H23 | 118.5° | 120.0° |
| C26 | C27 | N29 | H76 | 179.3° | 0.0° |
| C26 | C27 | N29 | H77 | 0.7° | 180.0° |
| O28 | C27 | C26 | H22 | 121.1° | 120.0° |
| O28 | C27 | C26 | H23 | 2.1° | 120.1° |
| O28 | C27 | N29 | H76 | 0.0° | 179.9° |
| O28 | C27 | N29 | H77 | 180.0° | 0.0° |
| N29 | C27 | C26 | H22 | 59.7° | 60.0° |
| N29 | C27 | C26 | H23 | 178.7° | 60.0° |
| C27 | N29 | H76 | H77 | 180.0° | 179.9° |
| H2 | C3 | C30 | H24 | 87.1° | 171.2° |
| H2 | C3 | C30 | H25 | 155.0° | 68.7° |
| H4 | C01 | H5 | H6 | 120.0° | 120.0° |
| H10 | C13 | C48 | H46 | 157.7° | 90.4° |
| H10 | C13 | C48 | H47 | 84.8° | 149.6° |
| H14 | C18 | C19 | H15 | 167.2° | 146.2° |
| H14 | C18 | C60 | H62 | 120.9° | 179.5° |
| H14 | C18 | C60 | H63 | 119.2° | 60.5° |
| H16 | C20 | H17 | H18 | 120.0° | 120.0° |
| H19 | C25 | H20 | H21 | 120.0° | 120.0° |
| H24 | C30 | C31 | H26 | 173.6° | 171.7° |
| H24 | C30 | C31 | H27 | 67.4° | 51.6° |
| H25 | C30 | C31 | H26 | 55.6° | 68.3° |
| H25 | C30 | C31 | H27 | 174.7° | 171.7° |
| H28 | C35 | H29 | H30 | 120.0° | 120.0° |
| H31 | C36 | H32 | H33 | 120.0° | 120.0° |
| H36 | C41 | C42 | H38 | 167.7° | 59.4° |
| H36 | C41 | C42 | H39 | 48.5° | 179.3° |
| H36 | C41 | C8 | H65 | 63.3° | 67.9° |
| H37 | C41 | C42 | H38 | 74.7° | 179.4° |
| H37 | C41 | C42 | H39 | 166.1° | 60.6° |
| H37 | C41 | C8 | H65 | 179.1° | 172.1° |
| H40 | C46 | H41 | H42 | 120.0° | 119.9° |
| H43 | C47 | H44 | H45 | 120.0° | 120.0° |
| H46 | C48 | C49 | H48 | 23.5° | 175.5° |
| H46 | C48 | C49 | H49 | 96.4° | 55.5° |
| H47 | C48 | C49 | H48 | 141.0° | 64.6° |
| H47 | C48 | C49 | H49 | 21.1° | 175.5° |
| H50 | C4L | C5L | H61 | 0.2° | 0.1° |
| H51 | C53 | H52 | H53 | 120.0° | 120.0° |
| H54 | C54 | H55 | H56 | 119.9° | 119.9° |
| H57 | C55 | C56 | H59 | 162.3° | 176.8° |
| H57 | C55 | C56 | H60 | 41.2° | 63.2° |
| H58 | C55 | C56 | H59 | 79.5° | 56.8° |
| H58 | C55 | C56 | H60 | 159.4° | 176.8° |
| H64 | C7L | C8L | H66 | 0.4° | 0.0° |
| H70 | CR1 | CR2 | H71 | 17.0° | 2.8° |
| H71 | CR2 | CR3 | H72 | 38.3° | 21.4° |
| H71 | CR2 | OR7 | H90 | 55.5° | 61.1° |
| H72 | CR3 | CR4 | H73 | 171.4° | 160.4° |
| H73 | CR4 | CR5 | H74 | 55.2° | 69.8° |
| H73 | CR4 | CR5 | H75 | 64.4° | 170.2° |
| H74 | CR5 | OR8 | H91 | 59.8° | 61.5° |
| H75 | CR5 | OR8 | H91 | 59.8° | 58.5° |
| H86 | N59 | CPR1 | H98 | 46.7° | 114.3° |
| H86 | N59 | CPR1 | H99 | 164.6° | 125.7° |
| H92 | CB10 | H93 | H94 | 120.0° | 119.9° |
| H95 | CB11 | H96 | H97 | 120.0° | 120.0° |
| H98 | CPR1 | CPR2 | H1 | 151.0° | 70.0° |
| H99 | CPR1 | CPR2 | H1 | 33.1° | 170.1° |
| H1 | CPR2 | CPR3 | H8 | 57.2° | 60.0° |
| H1 | CPR2 | CPR3 | H11 | 177.2° | 60.0° |
| H1 | CPR2 | CPR3 | H9 | 62.8° | 180.0° |
| H8 | CPR3 | H11 | H9 | 120.0° | 120.1° |
