EGY
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C2E | C2D | sing | 1.53Å | 1.55Å | |
C2C | C2D | sing | 1.53Å | 1.56Å | |
C2C | C2B | sing | 1.53Å | 1.55Å | |
C2B | C2A | sing | 1.53Å | 1.55Å | |
C3B | C3A | sing | 1.53Å | 1.55Å | |
C2A | C29 | sing | 1.53Å | 1.56Å | |
C29 | C28 | sing | 1.53Å | 1.56Å | |
C3A | C39 | sing | 1.53Å | 1.56Å | |
C39 | C38 | sing | 1.53Å | 1.56Å | |
C28 | C27 | sing | 1.53Å | 1.56Å | |
C27 | C26 | sing | 1.53Å | 1.55Å | |
C38 | C37 | sing | 1.53Å | 1.55Å | |
C25 | C26 | sing | 1.53Å | 1.56Å | |
C25 | C24 | sing | 1.53Å | 1.56Å | |
C37 | C36 | sing | 1.53Å | 1.55Å | |
C36 | C35 | sing | 1.53Å | 1.55Å | |
C24 | C23 | sing | 1.53Å | 1.55Å | |
C35 | C34 | sing | 1.53Å | 1.55Å | |
C34 | C33 | sing | 1.53Å | 1.54Å | |
C23 | C22 | sing | 1.53Å | 1.54Å | |
C22 | C21 | sing | 1.51Å | 1.56Å | |
C33 | C32 | sing | 1.53Å | 1.54Å | |
C32 | C31 | sing | 1.51Å | 1.55Å | |
C21 | O21 | sing | 1.34Å | 1.42Å | |
C21 | O22 | doub | 1.21Å | 1.18Å | |
O21 | C2 | sing | 1.45Å | 1.40Å | |
C31 | O32 | doub | 1.21Å | 1.18Å | |
C31 | O31 | sing | 1.34Å | 1.42Å | |
C14 | N | sing | 1.47Å | 1.46Å | |
C13 | N | sing | 1.47Å | 1.45Å | |
O31 | C3 | sing | 1.45Å | 1.42Å | |
C2 | C3 | sing | 1.53Å | 1.53Å | |
C2 | C1 | sing | 1.53Å | 1.52Å | |
O14 | P | doub | 1.48Å | 1.51Å | |
N | C15 | sing | 1.47Å | 1.45Å | |
N | C12 | sing | 1.47Å | 1.48Å | |
C1 | O11 | sing | 1.43Å | 1.41Å | |
O13 | P | sing | 1.61Å | 1.67Å | |
O13 | C11 | sing | 1.43Å | 1.43Å | |
O11 | P | sing | 1.61Å | 1.66Å | |
C12 | C11 | sing | 1.53Å | 1.55Å | |
P | O12 | sing | 1.61Å | 1.51Å | |
O12 | H1 | sing | 0.97Å | 0.95Å | |
C11 | H2 | sing | 1.09Å | 1.10Å | |
C11 | H3 | sing | 1.09Å | 1.10Å | |
C12 | H4 | sing | 1.09Å | 1.10Å | |
C12 | H5 | sing | 1.09Å | 1.10Å | |
C13 | H6 | sing | 1.09Å | 1.10Å | |
C13 | H7 | sing | 1.09Å | 1.10Å | |
C13 | H8 | sing | 1.09Å | 1.10Å | |
C14 | H9 | sing | 1.09Å | 1.10Å | |
C14 | H10 | sing | 1.09Å | 1.10Å | |
C14 | H11 | sing | 1.09Å | 1.10Å | |
C15 | H12 | sing | 1.09Å | 1.10Å | |
C15 | H13 | sing | 1.09Å | 1.10Å | |
C15 | H14 | sing | 1.09Å | 1.10Å | |
C1 | H15 | sing | 1.09Å | 1.10Å | |
C1 | H16 | sing | 1.09Å | 1.10Å | |
C2 | H17 | sing | 1.09Å | 1.10Å | |
C22 | H18 | sing | 1.09Å | 1.10Å | |
C22 | H19 | sing | 1.09Å | 1.10Å | |
C23 | H20 | sing | 1.09Å | 1.10Å | |
C23 | H21 | sing | 1.09Å | 1.10Å | |
C24 | H22 | sing | 1.09Å | 1.10Å | |
C24 | H23 | sing | 1.09Å | 1.10Å | |
C25 | H24 | sing | 1.09Å | 1.10Å | |
C25 | H25 | sing | 1.09Å | 1.10Å | |
C26 | H26 | sing | 1.09Å | 1.10Å | |
C26 | H27 | sing | 1.09Å | 1.10Å | |
C27 | H28 | sing | 1.09Å | 1.10Å | |
C27 | H29 | sing | 1.09Å | 1.10Å | |
C28 | H30 | sing | 1.09Å | 1.10Å | |
C28 | H31 | sing | 1.09Å | 1.10Å | |
C29 | H32 | sing | 1.09Å | 1.10Å | |
C29 | H33 | sing | 1.09Å | 1.10Å | |
C2A | H34 | sing | 1.09Å | 1.10Å | |
C2A | H35 | sing | 1.09Å | 1.10Å | |
C2B | H36 | sing | 1.09Å | 1.10Å | |
C2B | H37 | sing | 1.09Å | 1.10Å | |
C2C | H38 | sing | 1.09Å | 1.10Å | |
C2C | H39 | sing | 1.09Å | 1.10Å | |
C2D | H40 | sing | 1.09Å | 1.10Å | |
C2D | H41 | sing | 1.09Å | 1.10Å | |
C2E | H42 | sing | 1.09Å | 1.10Å | |
C2E | H43 | sing | 1.09Å | 1.10Å | |
C2E | H44 | sing | 1.09Å | 1.10Å | |
C3 | H45 | sing | 1.09Å | 1.10Å | |
C3 | H46 | sing | 1.09Å | 1.10Å | |
C32 | H47 | sing | 1.09Å | 1.10Å | |
C32 | H48 | sing | 1.09Å | 1.10Å | |
C33 | H49 | sing | 1.09Å | 1.10Å | |
C33 | H50 | sing | 1.09Å | 1.10Å | |
C34 | H51 | sing | 1.09Å | 1.10Å | |
C34 | H52 | sing | 1.09Å | 1.10Å | |
C35 | H53 | sing | 1.09Å | 1.10Å | |
C35 | H54 | sing | 1.09Å | 1.10Å | |
C36 | H55 | sing | 1.09Å | 1.10Å | |
C36 | H56 | sing | 1.09Å | 1.10Å | |
C37 | H57 | sing | 1.09Å | 1.10Å | |
C37 | H58 | sing | 1.09Å | 1.10Å | |
C38 | H59 | sing | 1.09Å | 1.10Å | |
C38 | H60 | sing | 1.09Å | 1.10Å | |
C39 | H61 | sing | 1.09Å | 1.10Å | |
C39 | H62 | sing | 1.09Å | 1.10Å | |
C3A | H63 | sing | 1.09Å | 1.10Å | |
C3A | H64 | sing | 1.09Å | 1.10Å | |
C3B | H65 | sing | 1.09Å | 1.10Å | |
C3B | H66 | sing | 1.09Å | 1.10Å | |
C3B | H67 | sing | 1.09Å | 1.10Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C2E | C2D | C2C | 110.2° | 109.5° |
C2E | C2D | H40 | 109.3° | 109.4° |
C2E | C2D | H41 | 109.3° | 109.5° |
C2D | C2E | H42 | 109.5° | 109.4° |
C2D | C2E | H43 | 109.5° | 109.5° |
C2D | C2E | H44 | 109.5° | 109.5° |
C2D | C2C | C2B | 109.9° | 109.5° |
C2D | C2C | H38 | 109.4° | 109.5° |
C2D | C2C | H39 | 109.4° | 109.4° |
C2C | C2D | H40 | 109.3° | 109.5° |
C2C | C2D | H41 | 109.3° | 109.5° |
C2C | C2B | C2A | 109.9° | 109.5° |
C2C | C2B | H36 | 109.4° | 109.5° |
C2C | C2B | H37 | 109.4° | 109.5° |
C2B | C2C | H38 | 109.3° | 109.5° |
C2B | C2C | H39 | 109.4° | 109.5° |
C2B | C2A | C29 | 108.5° | 109.5° |
C2B | C2A | H34 | 109.7° | 109.4° |
C2B | C2A | H35 | 109.7° | 109.5° |
C2A | C2B | H36 | 109.4° | 109.4° |
C2A | C2B | H37 | 109.4° | 109.5° |
C3B | C3A | C39 | 109.9° | 109.4° |
C3B | C3A | H63 | 109.4° | 109.5° |
C3B | C3A | H64 | 109.4° | 109.5° |
C3A | C3B | H65 | 109.5° | 109.5° |
C3A | C3B | H66 | 109.5° | 109.5° |
C3A | C3B | H67 | 109.4° | 109.4° |
C2A | C29 | C28 | 109.3° | 109.5° |
C2A | C29 | H32 | 109.5° | 109.4° |
C2A | C29 | H33 | 109.5° | 109.4° |
C29 | C2A | H34 | 109.7° | 109.4° |
C29 | C2A | H35 | 109.7° | 109.5° |
C29 | C28 | C27 | 109.8° | 109.5° |
C29 | C28 | H30 | 109.4° | 109.5° |
C29 | C28 | H31 | 109.4° | 109.5° |
C28 | C29 | H32 | 109.5° | 109.4° |
C28 | C29 | H33 | 109.5° | 109.5° |
C3A | C39 | C38 | 108.7° | 109.5° |
C3A | C39 | H61 | 109.7° | 109.5° |
C3A | C39 | H62 | 109.7° | 109.5° |
C39 | C3A | H63 | 109.4° | 109.5° |
C39 | C3A | H64 | 109.4° | 109.5° |
C39 | C38 | C37 | 110.1° | 109.5° |
C39 | C38 | H59 | 109.3° | 109.5° |
C39 | C38 | H60 | 109.3° | 109.5° |
C38 | C39 | H61 | 109.7° | 109.4° |
C38 | C39 | H62 | 109.7° | 109.4° |
C28 | C27 | C26 | 109.3° | 109.5° |
C28 | C27 | H28 | 109.5° | 109.5° |
C28 | C27 | H29 | 109.5° | 109.5° |
C27 | C28 | H30 | 109.4° | 109.5° |
C27 | C28 | H31 | 109.4° | 109.5° |
C27 | C26 | C25 | 108.7° | 109.5° |
C27 | C26 | H26 | 109.7° | 109.5° |
C27 | C26 | H27 | 109.7° | 109.5° |
C26 | C27 | H28 | 109.5° | 109.5° |
C26 | C27 | H29 | 109.5° | 109.5° |
C38 | C37 | C36 | 108.7° | 109.5° |
C38 | C37 | H57 | 109.7° | 109.5° |
C38 | C37 | H58 | 109.6° | 109.4° |
C37 | C38 | H59 | 109.3° | 109.5° |
C37 | C38 | H60 | 109.3° | 109.4° |
C26 | C25 | C24 | 110.7° | 109.5° |
C26 | C25 | H24 | 109.1° | 109.5° |
C26 | C25 | H25 | 109.1° | 109.5° |
C25 | C26 | H26 | 109.7° | 109.5° |
C25 | C26 | H27 | 109.7° | 109.5° |
C25 | C24 | C23 | 110.5° | 109.4° |
C25 | C24 | H22 | 109.2° | 109.4° |
C25 | C24 | H23 | 109.2° | 109.5° |
C24 | C25 | H24 | 109.1° | 109.5° |
C24 | C25 | H25 | 109.2° | 109.5° |
C37 | C36 | C35 | 109.4° | 109.5° |
C37 | C36 | H55 | 109.5° | 109.5° |
C37 | C36 | H56 | 109.5° | 109.5° |
C36 | C37 | H57 | 109.7° | 109.5° |
C36 | C37 | H58 | 109.6° | 109.5° |
C36 | C35 | C34 | 107.6° | 109.5° |
C36 | C35 | H53 | 109.9° | 109.4° |
C36 | C35 | H54 | 109.9° | 109.5° |
C35 | C36 | H55 | 109.5° | 109.4° |
C35 | C36 | H56 | 109.5° | 109.5° |
C24 | C23 | C22 | 106.8° | 109.4° |
C24 | C23 | H20 | 110.1° | 109.5° |
C24 | C23 | H21 | 110.1° | 109.5° |
C23 | C24 | H22 | 109.2° | 109.4° |
C23 | C24 | H23 | 109.2° | 109.5° |
C35 | C34 | C33 | 109.7° | 109.5° |
C35 | C34 | H51 | 109.4° | 109.5° |
C35 | C34 | H52 | 109.4° | 109.4° |
C34 | C35 | H53 | 109.9° | 109.5° |
C34 | C35 | H54 | 109.9° | 109.5° |
C34 | C33 | C32 | 106.3° | 109.5° |
C34 | C33 | H49 | 110.2° | 109.5° |
C34 | C33 | H50 | 110.3° | 109.4° |
C33 | C34 | H51 | 109.4° | 109.5° |
C33 | C34 | H52 | 109.4° | 109.4° |
C23 | C22 | C21 | 111.3° | 109.5° |
C23 | C22 | H18 | 109.0° | 109.5° |
C23 | C22 | H19 | 109.0° | 109.4° |
C22 | C23 | H20 | 110.1° | 109.5° |
C22 | C23 | H21 | 110.1° | 109.5° |
C22 | C21 | O21 | 120.7° | 120.0° |
C22 | C21 | O22 | 118.3° | 120.0° |
C21 | C22 | H18 | 109.0° | 109.5° |
C21 | C22 | H19 | 109.0° | 109.5° |
C33 | C32 | C31 | 111.0° | 109.5° |
C33 | C32 | H47 | 109.1° | 109.5° |
C33 | C32 | H48 | 109.1° | 109.5° |
C32 | C33 | H49 | 110.3° | 109.5° |
C32 | C33 | H50 | 110.3° | 109.4° |
C32 | C31 | O32 | 120.0° | 120.0° |
C32 | C31 | O31 | 119.2° | 120.0° |
C31 | C32 | H47 | 109.1° | 109.5° |
C31 | C32 | H48 | 109.1° | 109.5° |
O21 | C21 | O22 | 121.0° | 120.0° |
C21 | O21 | C2 | 115.7° | 117.0° |
O21 | C2 | C3 | 109.2° | 109.5° |
O21 | C2 | C1 | 108.6° | 109.5° |
O21 | C2 | H17 | 111.8° | 109.5° |
O32 | C31 | O31 | 120.8° | 119.9° |
C31 | O31 | C3 | 113.3° | 117.0° |
C14 | N | C13 | 108.2° | 109.4° |
C14 | N | C15 | 109.5° | 109.5° |
C14 | N | C12 | 113.4° | 109.5° |
N | C14 | H9 | 109.5° | 109.5° |
N | C14 | H10 | 109.4° | 109.5° |
N | C14 | H11 | 109.5° | 109.5° |
C13 | N | C15 | 109.9° | 109.5° |
C13 | N | C12 | 108.0° | 109.5° |
N | C13 | H6 | 109.5° | 109.5° |
N | C13 | H7 | 109.5° | 109.5° |
N | C13 | H8 | 109.4° | 109.5° |
O31 | C3 | C2 | 110.2° | 109.5° |
O31 | C3 | H45 | 109.3° | 109.4° |
O31 | C3 | H46 | 109.3° | 109.5° |
C3 | C2 | C1 | 107.1° | 109.5° |
C3 | C2 | H17 | 110.0° | 109.4° |
C2 | C3 | H45 | 109.3° | 109.5° |
C2 | C3 | H46 | 109.3° | 109.5° |
C2 | C1 | O11 | 108.1° | 109.4° |
C2 | C1 | H15 | 109.8° | 109.5° |
C2 | C1 | H16 | 109.8° | 109.5° |
C1 | C2 | H17 | 110.0° | 109.5° |
O14 | P | O13 | 110.2° | 109.5° |
O14 | P | O11 | 107.6° | 109.5° |
O14 | P | O12 | 110.5° | 109.4° |
C15 | N | C12 | 107.8° | 109.5° |
N | C15 | H12 | 109.5° | 109.5° |
N | C15 | H13 | 109.5° | 109.5° |
N | C15 | H14 | 109.5° | 109.5° |
N | C12 | C11 | 113.2° | 109.4° |
N | C12 | H4 | 108.5° | 109.5° |
N | C12 | H5 | 108.5° | 109.5° |
C1 | O11 | P | 117.1° | 123.0° |
O11 | C1 | H15 | 109.8° | 109.4° |
O11 | C1 | H16 | 109.8° | 109.4° |
P | O13 | C11 | 119.2° | 123.0° |
O13 | P | O11 | 109.0° | 109.5° |
O13 | P | O12 | 110.1° | 109.4° |
O13 | C11 | C12 | 110.4° | 109.5° |
O13 | C11 | H2 | 109.2° | 109.5° |
O13 | C11 | H3 | 109.2° | 109.5° |
O11 | P | O12 | 109.4° | 109.5° |
C12 | C11 | H2 | 109.2° | 109.5° |
C12 | C11 | H3 | 109.2° | 109.4° |
C11 | C12 | H4 | 108.5° | 109.5° |
C11 | C12 | H5 | 108.5° | 109.4° |
P | O12 | H1 | 109.5° | 114.0° |
H2 | C11 | H3 | 109.5° | 109.4° |
H4 | C12 | H5 | 109.5° | 109.5° |
H6 | C13 | H7 | 109.5° | 109.5° |
H6 | C13 | H8 | 109.5° | 109.4° |
H7 | C13 | H8 | 109.5° | 109.4° |
H9 | C14 | H10 | 109.5° | 109.5° |
H9 | C14 | H11 | 109.5° | 109.4° |
H10 | C14 | H11 | 109.5° | 109.5° |
H12 | C15 | H13 | 109.5° | 109.5° |
H12 | C15 | H14 | 109.4° | 109.5° |
H13 | C15 | H14 | 109.5° | 109.5° |
H15 | C1 | H16 | 109.4° | 109.5° |
H18 | C22 | H19 | 109.4° | 109.5° |
H20 | C23 | H21 | 109.5° | 109.4° |
H22 | C24 | H23 | 109.5° | 109.6° |
H24 | C25 | H25 | 109.5° | 109.5° |
H26 | C26 | H27 | 109.5° | 109.5° |
H28 | C27 | H29 | 109.5° | 109.5° |
H30 | C28 | H31 | 109.5° | 109.4° |
H32 | C29 | H33 | 109.5° | 109.5° |
H34 | C2A | H35 | 109.4° | 109.5° |
H36 | C2B | H37 | 109.5° | 109.4° |
H38 | C2C | H39 | 109.5° | 109.5° |
H40 | C2D | H41 | 109.5° | 109.4° |
H42 | C2E | H43 | 109.5° | 109.5° |
H42 | C2E | H44 | 109.5° | 109.4° |
H43 | C2E | H44 | 109.4° | 109.5° |
H45 | C3 | H46 | 109.5° | 109.5° |
H47 | C32 | H48 | 109.5° | 109.4° |
H49 | C33 | H50 | 109.5° | 109.5° |
H51 | C34 | H52 | 109.5° | 109.5° |
H53 | C35 | H54 | 109.5° | 109.5° |
H55 | C36 | H56 | 109.5° | 109.5° |
H57 | C37 | H58 | 109.5° | 109.5° |
H59 | C38 | H60 | 109.5° | 109.5° |
H61 | C39 | H62 | 109.4° | 109.5° |
H63 | C3A | H64 | 109.5° | 109.5° |
H65 | C3B | H66 | 109.5° | 109.5° |
H65 | C3B | H67 | 109.5° | 109.4° |
H66 | C3B | H67 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C2E | C2D | C2C | H40 | 120.1° | 120.0° |
C2E | C2D | C2C | H41 | 120.1° | 120.0° |
C2E | C2D | C2C | C2B | 142.7° | 180.0° |
C2E | C2D | C2C | H38 | 22.7° | 60.0° |
C2E | C2D | C2C | H39 | 97.2° | 60.0° |
C2E | C2D | H40 | H41 | 119.7° | 120.0° |
C2D | C2E | H42 | H43 | 120.0° | 120.0° |
C2D | C2E | H42 | H44 | 120.0° | 119.9° |
C2D | C2E | H43 | H44 | 120.0° | 120.0° |
C2D | C2C | C2B | H38 | 120.0° | 120.0° |
C2D | C2C | C2B | H39 | 120.1° | 120.0° |
C2D | C2C | C2B | C2A | 56.5° | 180.0° |
C2D | C2C | C2B | H36 | 63.6° | 60.0° |
C2D | C2C | C2B | H37 | 176.6° | 60.0° |
C2D | C2C | H38 | H39 | 119.8° | 120.0° |
C2C | C2D | H40 | H41 | 119.7° | 120.0° |
C2C | C2D | C2E | H42 | 180.0° | 60.1° |
C2C | C2D | C2E | H43 | 60.0° | 60.0° |
C2C | C2D | C2E | H44 | 60.0° | 180.0° |
C2C | C2B | C2A | H36 | 120.0° | 120.0° |
C2C | C2B | C2A | H37 | 120.1° | 120.0° |
C2C | C2B | C2A | C29 | 128.2° | 180.0° |
C2C | C2B | C2A | H34 | 8.3° | 60.0° |
C2C | C2B | C2A | H35 | 112.0° | 60.0° |
C2C | C2B | H36 | H37 | 119.8° | 120.0° |
C2B | C2C | H38 | H39 | 119.8° | 120.0° |
C2B | C2C | C2D | H40 | 97.2° | 60.0° |
C2B | C2C | C2D | H41 | 22.6° | 60.0° |
C2B | C2A | C29 | H34 | 119.8° | 119.9° |
C2B | C2A | C29 | H35 | 119.9° | 120.0° |
C2B | C2A | C29 | C28 | 131.1° | 180.0° |
C2B | C2A | C29 | H32 | 11.1° | 60.1° |
C2B | C2A | C29 | H33 | 108.9° | 60.0° |
C2B | C2A | H34 | H35 | 120.4° | 120.0° |
C2A | C2B | H36 | H37 | 119.8° | 119.9° |
C2A | C2B | C2C | H38 | 176.5° | 60.0° |
C2A | C2B | C2C | H39 | 63.6° | 60.0° |
C3B | C3A | C39 | H63 | 120.0° | 120.0° |
C3B | C3A | C39 | H64 | 120.0° | 120.0° |
C3B | C3A | C39 | C38 | 138.5° | 180.0° |
C3B | C3A | C39 | H61 | 101.6° | 60.0° |
C3B | C3A | C39 | H62 | 18.6° | 60.0° |
C3B | C3A | H63 | H64 | 119.8° | 120.0° |
C3A | C3B | H65 | H66 | 120.0° | 120.0° |
C3A | C3B | H65 | H67 | 120.0° | 120.0° |
C3A | C3B | H66 | H67 | 120.0° | 120.0° |
C2A | C29 | C28 | H32 | 120.0° | 119.9° |
C2A | C29 | C28 | H33 | 120.0° | 120.0° |
C2A | C29 | C28 | C27 | 139.3° | 180.0° |
C2A | C29 | C28 | H30 | 19.3° | 60.0° |
C2A | C29 | C28 | H31 | 100.6° | 60.0° |
C2A | C29 | H32 | H33 | 120.1° | 120.0° |
C29 | C2A | H34 | H35 | 120.5° | 120.1° |
C29 | C2A | C2B | H36 | 111.8° | 60.0° |
C29 | C2A | C2B | H37 | 8.1° | 59.9° |
C29 | C28 | C27 | H30 | 120.0° | 120.0° |
C29 | C28 | C27 | H31 | 120.0° | 120.0° |
C29 | C28 | C27 | C26 | 130.8° | NaN° |
C29 | C28 | C27 | H28 | 10.8° | 60.0° |
C29 | C28 | C27 | H29 | 109.2° | 60.0° |
C29 | C28 | H30 | H31 | 119.8° | 120.0° |
C28 | C29 | H32 | H33 | 120.1° | 120.1° |
C28 | C29 | C2A | H34 | 109.1° | 60.0° |
C28 | C29 | C2A | H35 | 11.2° | 60.0° |
C3A | C39 | C38 | H61 | 119.9° | 120.0° |
C3A | C39 | C38 | H62 | 119.9° | 120.0° |
C3A | C39 | C38 | C37 | 171.4° | 180.0° |
C3A | C39 | C38 | H59 | 68.5° | 60.0° |
C3A | C39 | C38 | H60 | 51.3° | 60.0° |
C3A | C39 | H61 | H62 | 120.4° | 120.1° |
C39 | C3A | H63 | H64 | 119.8° | 120.0° |
C39 | C3A | C3B | H65 | 180.0° | 60.0° |
C39 | C3A | C3B | H66 | 60.0° | 60.0° |
C39 | C3A | C3B | H67 | 60.0° | 180.0° |
C39 | C38 | C37 | H59 | 120.1° | 120.0° |
C39 | C38 | C37 | H60 | 120.1° | 120.0° |
C39 | C38 | C37 | C36 | 62.2° | 180.0° |
C39 | C38 | C37 | H57 | 57.7° | 60.0° |
C39 | C38 | C37 | H58 | 177.9° | 60.0° |
C39 | C38 | H59 | H60 | 119.8° | 120.0° |
C38 | C39 | H61 | H62 | 120.4° | 119.9° |
C38 | C39 | C3A | H63 | 18.4° | 60.0° |
C38 | C39 | C3A | H64 | 101.5° | 60.0° |
C28 | C27 | C26 | H28 | 120.0° | 120.0° |
C28 | C27 | C26 | H29 | 119.9° | 120.0° |
C28 | C27 | C26 | C25 | 99.0° | 180.0° |
C28 | C27 | C26 | H26 | 141.2° | 60.0° |
C28 | C27 | C26 | H27 | 20.9° | 60.0° |
C28 | C27 | H28 | H29 | 120.1° | 120.0° |
C27 | C28 | H30 | H31 | 119.9° | 120.0° |
C27 | C28 | C29 | H32 | 100.7° | 60.0° |
C27 | C28 | C29 | H33 | 19.3° | 60.1° |
C27 | C26 | C25 | H26 | 119.9° | 120.0° |
C27 | C26 | C25 | H27 | 119.9° | 120.0° |
C27 | C26 | C25 | C24 | 179.8° | 180.0° |
C27 | C26 | C25 | H24 | 60.0° | 60.0° |
C27 | C26 | C25 | H25 | 59.6° | 60.0° |
C27 | C26 | H26 | H27 | 120.4° | 120.0° |
C26 | C27 | H28 | H29 | 120.1° | 120.0° |
C26 | C27 | C28 | H30 | 109.1° | 60.0° |
C26 | C27 | C28 | H31 | 10.8° | 60.0° |
C38 | C37 | C36 | H57 | 119.9° | 120.0° |
C38 | C37 | C36 | H58 | 119.9° | 119.9° |
C38 | C37 | C36 | C35 | 160.1° | 180.0° |
C38 | C37 | C36 | H55 | 40.2° | 60.0° |
C38 | C37 | C36 | H56 | 79.9° | 60.0° |
C38 | C37 | H57 | H58 | 120.3° | 120.0° |
C37 | C38 | H59 | H60 | 119.7° | 119.9° |
C37 | C38 | C39 | H61 | 51.5° | 60.0° |
C37 | C38 | C39 | H62 | 68.7° | 60.0° |
C26 | C25 | C24 | H24 | 120.2° | 120.0° |
C26 | C25 | C24 | H25 | 120.2° | 120.0° |
C26 | C25 | C24 | C23 | 56.0° | 180.0° |
C26 | C25 | C24 | H22 | 64.1° | 60.0° |
C26 | C25 | C24 | H23 | 176.2° | 60.0° |
C26 | C25 | H24 | H25 | 119.4° | 120.0° |
C25 | C26 | H26 | H27 | 120.4° | 120.0° |
C25 | C26 | C27 | H28 | 21.0° | 60.0° |
C25 | C26 | C27 | H29 | 141.1° | 60.0° |
C25 | C24 | C23 | H22 | 120.1° | 119.9° |
C25 | C24 | C23 | H23 | 120.2° | 120.0° |
C25 | C24 | C23 | C22 | 169.3° | 180.0° |
C25 | C24 | C23 | H20 | 71.1° | 60.0° |
C25 | C24 | C23 | H21 | 49.7° | 60.0° |
C25 | C24 | H22 | H23 | 119.5° | 120.0° |
C24 | C25 | H24 | H25 | 119.4° | 120.0° |
C24 | C25 | C26 | H26 | 59.9° | 60.0° |
C24 | C25 | C26 | H27 | 60.3° | 60.0° |
C37 | C36 | C35 | H55 | 120.0° | 120.0° |
C37 | C36 | C35 | H56 | 120.0° | 120.0° |
C37 | C36 | C35 | C34 | 169.7° | 180.0° |
C37 | C36 | C35 | H53 | 50.0° | 60.0° |
C37 | C36 | C35 | H54 | 70.6° | 60.0° |
C37 | C36 | H55 | H56 | 120.0° | 120.1° |
C36 | C37 | H57 | H58 | 120.3° | 120.0° |
C36 | C37 | C38 | H59 | 177.7° | 60.0° |
C36 | C37 | C38 | H60 | 57.9° | 60.0° |
C36 | C35 | C34 | H53 | 119.7° | 120.0° |
C36 | C35 | C34 | H54 | 119.7° | 120.0° |
C36 | C35 | C34 | C33 | 156.9° | 180.0° |
C36 | C35 | C34 | H51 | 36.8° | 60.0° |
C36 | C35 | C34 | H52 | 83.1° | 60.0° |
C36 | C35 | H53 | H54 | 120.8° | 120.0° |
C35 | C36 | H55 | H56 | 120.1° | 120.0° |
C35 | C36 | C37 | H57 | 80.0° | 60.0° |
C35 | C36 | C37 | H58 | 40.3° | 60.0° |
C24 | C23 | C22 | H20 | 119.6° | 120.0° |
C24 | C23 | C22 | H21 | 119.6° | 120.1° |
C24 | C23 | C22 | C21 | 176.7° | 180.0° |
C24 | C23 | C22 | H18 | 63.0° | 60.0° |
C24 | C23 | C22 | H19 | 56.4° | 60.0° |
C24 | C23 | H20 | H21 | 121.2° | 120.1° |
C23 | C24 | H22 | H23 | 119.5° | 120.1° |
C23 | C24 | C25 | H24 | 176.2° | 60.0° |
C23 | C24 | C25 | H25 | 64.1° | 59.9° |
C35 | C34 | C33 | H51 | 120.1° | 120.0° |
C35 | C34 | C33 | H52 | 120.0° | 120.0° |
C35 | C34 | C33 | C32 | 170.6° | 180.0° |
C35 | C34 | C33 | H49 | 69.9° | 60.0° |
C35 | C34 | C33 | H50 | 51.1° | 60.0° |
C35 | C34 | H51 | H52 | 119.9° | 120.0° |
C34 | C35 | H53 | H54 | 120.9° | 120.0° |
C34 | C35 | C36 | H55 | 70.4° | 60.0° |
C34 | C35 | C36 | H56 | 49.7° | 60.0° |
C34 | C33 | C32 | H49 | 119.5° | 120.1° |
C34 | C33 | C32 | H50 | 119.5° | 119.9° |
C34 | C33 | C32 | C31 | 159.0° | 180.0° |
C34 | C33 | C32 | H47 | 80.8° | 59.9° |
C34 | C33 | C32 | H48 | 38.8° | 60.0° |
C34 | C33 | H49 | H50 | 121.5° | 120.0° |
C33 | C34 | H51 | H52 | 119.9° | 120.0° |
C33 | C34 | C35 | H53 | 83.4° | 60.0° |
C33 | C34 | C35 | H54 | 37.2° | 60.0° |
C23 | C22 | C21 | H18 | 120.3° | 120.0° |
C23 | C22 | C21 | H19 | 120.3° | 119.9° |
C23 | C22 | C21 | O21 | 37.8° | 180.0° |
C23 | C22 | C21 | O22 | 142.5° | 0.0° |
C23 | C22 | H18 | H19 | 119.2° | 120.0° |
C22 | C23 | H20 | H21 | 121.2° | 120.0° |
C22 | C23 | C24 | H22 | 49.2° | 60.1° |
C22 | C23 | C24 | H23 | 70.5° | 60.0° |
C22 | C21 | O21 | O22 | 179.7° | 180.0° |
C22 | C21 | O21 | C2 | 155.7° | 180.0° |
C21 | C22 | H18 | H19 | 119.1° | 120.0° |
C21 | C22 | C23 | H20 | 57.1° | 60.0° |
C21 | C22 | C23 | H21 | 63.7° | 60.0° |
C33 | C32 | C31 | H47 | 120.2° | 120.1° |
C33 | C32 | C31 | H48 | 120.2° | 120.0° |
C33 | C32 | C31 | O32 | 42.8° | 0.0° |
C33 | C32 | C31 | O31 | 137.3° | 180.0° |
C33 | C32 | H47 | H48 | 119.3° | 120.0° |
C32 | C33 | H49 | H50 | 121.5° | 120.0° |
C32 | C33 | C34 | H51 | 50.5° | 60.0° |
C32 | C33 | C34 | H52 | 69.4° | 60.0° |
C32 | C31 | O32 | O31 | 180.0° | 180.0° |
C32 | C31 | O31 | C3 | 120.8° | 180.0° |
C31 | C32 | H47 | H48 | 119.3° | 119.9° |
C31 | C32 | C33 | H49 | 39.5° | 60.0° |
C31 | C32 | C33 | H50 | 81.5° | 60.0° |
C21 | O21 | C2 | C3 | 147.5° | 150.0° |
C21 | O21 | C2 | C1 | 96.0° | 90.0° |
C21 | O21 | C2 | H17 | 25.6° | 30.1° |
O21 | C21 | C22 | H18 | 82.5° | 60.0° |
O21 | C21 | C22 | H19 | 158.1° | 60.0° |
O22 | C21 | O21 | C2 | 24.0° | 0.0° |
O22 | C21 | C22 | H18 | 97.2° | 120.0° |
O22 | C21 | C22 | H19 | 22.2° | 119.9° |
O21 | C2 | C3 | O31 | 65.9° | 65.0° |
O21 | C2 | C3 | C1 | 117.4° | 120.1° |
O21 | C2 | C3 | H17 | 123.0° | 120.0° |
O21 | C2 | C1 | H17 | 122.7° | 120.0° |
O21 | C2 | C1 | O11 | 108.1° | 65.0° |
O21 | C2 | C1 | H15 | 11.7° | 54.9° |
O21 | C2 | C1 | H16 | 132.1° | 175.1° |
O21 | C2 | C3 | H45 | 54.2° | 55.0° |
O21 | C2 | C3 | H46 | 174.0° | 175.0° |
O32 | C31 | O31 | C3 | 59.2° | 0.0° |
O32 | C31 | C32 | H47 | 163.0° | 120.0° |
O32 | C31 | C32 | H48 | 77.5° | 120.1° |
C31 | O31 | C3 | C2 | 124.3° | 180.0° |
C31 | O31 | C3 | H45 | 4.2° | 60.0° |
C31 | O31 | C3 | H46 | 115.6° | 59.9° |
O31 | C31 | C32 | H47 | 17.1° | 60.0° |
O31 | C31 | C32 | H48 | 102.5° | 59.9° |
C14 | N | C13 | C15 | 119.5° | 120.0° |
C14 | N | C13 | C12 | 123.1° | 120.0° |
C14 | N | C15 | C12 | 123.8° | 120.1° |
C14 | N | C12 | C11 | 50.7° | 57.3° |
C14 | N | C12 | H4 | 69.8° | 177.3° |
C14 | N | C12 | H5 | 171.3° | 62.7° |
C14 | N | C13 | H6 | 180.0° | 180.0° |
C14 | N | C13 | H7 | 60.0° | 60.0° |
C14 | N | C13 | H8 | 60.0° | 60.0° |
N | C14 | H9 | H10 | 120.0° | 120.0° |
N | C14 | H9 | H11 | 120.0° | 120.0° |
N | C14 | H10 | H11 | 120.0° | 120.0° |
C14 | N | C15 | H12 | 180.0° | 180.0° |
C14 | N | C15 | H13 | 60.0° | 60.0° |
C14 | N | C15 | H14 | 60.0° | 60.0° |
C13 | N | C15 | C12 | 117.5° | 120.0° |
C13 | N | C12 | C11 | 170.6° | 177.2° |
C13 | N | C12 | H4 | 50.0° | 62.8° |
C13 | N | C12 | H5 | 68.9° | 57.3° |
N | C13 | H6 | H7 | 120.0° | 120.0° |
N | C13 | H6 | H8 | 120.0° | 120.0° |
N | C13 | H7 | H8 | 119.9° | 120.0° |
C13 | N | C14 | H9 | 180.0° | 51.1° |
C13 | N | C14 | H10 | 60.0° | 69.0° |
C13 | N | C14 | H11 | 60.0° | 171.0° |
C13 | N | C15 | H12 | 61.3° | 60.0° |
C13 | N | C15 | H13 | 58.7° | 60.0° |
C13 | N | C15 | H14 | 178.7° | 180.0° |
O31 | C3 | C2 | H45 | 120.1° | 120.0° |
O31 | C3 | C2 | H46 | 120.1° | 120.0° |
O31 | C3 | C2 | C1 | 176.6° | 55.1° |
O31 | C3 | C2 | H17 | 57.1° | 175.0° |
O31 | C3 | H45 | H46 | 119.7° | 120.0° |
C3 | C2 | C1 | H17 | 119.5° | 119.9° |
C3 | C2 | C1 | O11 | 134.1° | 55.0° |
C3 | C2 | C1 | H15 | 106.1° | 175.0° |
C3 | C2 | C1 | H16 | 14.3° | 64.9° |
C2 | C3 | H45 | H46 | 119.7° | 120.0° |
C2 | C1 | O11 | H15 | 119.8° | 120.0° |
C2 | C1 | O11 | H16 | 119.8° | 120.0° |
C2 | C1 | O11 | P | 157.1° | 180.0° |
C2 | C1 | H15 | H16 | 120.6° | 120.1° |
C1 | C2 | C3 | H45 | 63.3° | 175.0° |
C1 | C2 | C3 | H46 | 56.5° | 65.0° |
O14 | P | O11 | C1 | 87.1° | 55.0° |
O14 | P | O13 | O11 | 117.8° | 120.0° |
O14 | P | O13 | O12 | 122.1° | 119.9° |
O14 | P | O13 | C11 | 90.5° | 55.0° |
O14 | P | O11 | O12 | 120.1° | 120.0° |
O14 | P | O12 | H1 | 0.0° | 180.0° |
C15 | N | C12 | C11 | 70.8° | 62.8° |
C15 | N | C12 | H4 | 168.7° | 57.2° |
C15 | N | C12 | H5 | 49.8° | 177.3° |
C15 | N | C13 | H6 | 60.5° | 60.0° |
C15 | N | C13 | H7 | 179.5° | 180.0° |
C15 | N | C13 | H8 | 59.6° | 60.0° |
C15 | N | C14 | H9 | 60.3° | 68.9° |
C15 | N | C14 | H10 | 59.8° | 171.0° |
C15 | N | C14 | H11 | 179.7° | 51.0° |
N | C15 | H12 | H13 | 120.0° | 120.0° |
N | C15 | H12 | H14 | 120.0° | 120.0° |
N | C15 | H13 | H14 | 120.0° | 120.0° |
N | C12 | C11 | O13 | 105.0° | 69.8° |
N | C12 | C11 | H4 | 120.6° | 120.0° |
N | C12 | C11 | H5 | 120.6° | 120.0° |
N | C12 | C11 | H2 | 15.2° | 50.3° |
N | C12 | C11 | H3 | 134.9° | 170.2° |
N | C12 | H4 | H5 | 118.3° | 120.0° |
C12 | N | C13 | H6 | 56.9° | 60.0° |
C12 | N | C13 | H7 | 63.1° | 60.0° |
C12 | N | C13 | H8 | 176.9° | 180.0° |
C12 | N | C14 | H9 | 60.2° | 171.0° |
C12 | N | C14 | H10 | 179.7° | 51.0° |
C12 | N | C14 | H11 | 59.8° | 69.0° |
C12 | N | C15 | H12 | 56.1° | 60.0° |
C12 | N | C15 | H13 | 176.2° | 180.0° |
C12 | N | C15 | H14 | 63.8° | 60.0° |
C1 | O11 | P | O13 | 32.3° | 175.0° |
C1 | O11 | P | O12 | 152.8° | 65.0° |
O11 | C1 | H15 | H16 | 120.6° | 119.9° |
O11 | C1 | C2 | H17 | 14.6° | 175.0° |
O13 | P | O11 | O12 | 120.5° | 120.0° |
P | O13 | C11 | C12 | 57.1° | 180.0° |
O13 | P | O12 | H1 | 121.9° | 60.1° |
P | O13 | C11 | H2 | 177.2° | 60.0° |
P | O13 | C11 | H3 | 63.1° | 60.0° |
C11 | O13 | P | O11 | 151.6° | 175.0° |
O13 | C11 | C12 | H2 | 120.1° | 120.1° |
O13 | C11 | C12 | H3 | 120.1° | 120.0° |
C11 | O13 | P | O12 | 31.6° | 65.0° |
O13 | C11 | H2 | H3 | 119.5° | 120.0° |
O13 | C11 | C12 | H4 | 15.6° | 170.2° |
O13 | C11 | C12 | H5 | 134.5° | 50.2° |
O11 | P | O12 | H1 | 118.3° | 59.9° |
P | O11 | C1 | H15 | 37.3° | 60.0° |
P | O11 | C1 | H16 | 83.1° | 60.0° |
C12 | C11 | H2 | H3 | 119.6° | 119.9° |
C11 | C12 | H4 | H5 | 118.3° | 120.0° |
H2 | C11 | C12 | H4 | 135.7° | 69.7° |
H2 | C11 | C12 | H5 | 105.4° | 170.3° |
H3 | C11 | C12 | H4 | 104.5° | 50.2° |
H3 | C11 | C12 | H5 | 14.3° | 69.8° |
H6 | C13 | H7 | H8 | 120.0° | 119.9° |
H9 | C14 | H10 | H11 | 120.0° | 120.0° |
H12 | C15 | H13 | H14 | 120.0° | 120.0° |
H15 | C1 | C2 | H17 | 134.4° | 65.1° |
H16 | C1 | C2 | H17 | 105.2° | 55.0° |
H17 | C2 | C3 | H45 | 177.2° | 65.0° |
H17 | C2 | C3 | H46 | 63.0° | 55.0° |
H18 | C22 | C23 | H20 | 177.4° | 180.0° |
H18 | C22 | C23 | H21 | 56.6° | 60.0° |
H19 | C22 | C23 | H20 | 63.2° | 60.0° |
H19 | C22 | C23 | H21 | 176.0° | 179.9° |
H20 | C23 | C24 | H22 | 168.8° | 180.0° |
H20 | C23 | C24 | H23 | 49.1° | 60.0° |
H21 | C23 | C24 | H22 | 70.4° | 59.9° |
H21 | C23 | C24 | H23 | 169.9° | 180.0° |
H22 | C24 | C25 | H24 | 56.0° | 180.0° |
H22 | C24 | C25 | H25 | 175.7° | 60.0° |
H23 | C24 | C25 | H24 | 63.6° | 60.0° |
H23 | C24 | C25 | H25 | 56.1° | 179.9° |
H24 | C25 | C26 | H26 | 179.9° | 180.0° |
H24 | C25 | C26 | H27 | 59.9° | 60.0° |
H25 | C25 | C26 | H26 | 60.3° | 60.0° |
H25 | C25 | C26 | H27 | 179.5° | 180.0° |
H26 | C26 | C27 | H28 | 98.9° | 180.0° |
H26 | C26 | C27 | H29 | 21.2° | 60.0° |
H27 | C26 | C27 | H28 | 140.9° | 60.0° |
H27 | C26 | C27 | H29 | 99.0° | 180.0° |
H28 | C27 | C28 | H30 | 130.9° | 180.0° |
H28 | C27 | C28 | H31 | 109.2° | 60.0° |
H29 | C27 | C28 | H30 | 10.8° | 60.0° |
H29 | C27 | C28 | H31 | 130.7° | 180.0° |
H30 | C28 | C29 | H32 | 139.2° | 179.9° |
H30 | C28 | C29 | H33 | 100.7° | 60.0° |
H31 | C28 | C29 | H32 | 19.4° | 60.0° |
H31 | C28 | C29 | H33 | 139.4° | 179.9° |
H32 | C29 | C2A | H34 | 131.0° | 180.0° |
H32 | C29 | C2A | H35 | 108.7° | 60.0° |
H33 | C29 | C2A | H34 | 10.9° | 60.0° |
H33 | C29 | C2A | H35 | 131.2° | 180.0° |
H34 | C2A | C2B | H36 | 128.3° | 180.0° |
H34 | C2A | C2B | H37 | 111.8° | 60.0° |
H35 | C2A | C2B | H36 | 8.1° | 60.1° |
H35 | C2A | C2B | H37 | 128.0° | 180.0° |
H36 | C2B | C2C | H38 | 56.5° | 180.0° |
H36 | C2B | C2C | H39 | 176.4° | 60.0° |
H37 | C2B | C2C | H38 | 63.4° | 60.0° |
H37 | C2B | C2C | H39 | 56.5° | 180.0° |
H38 | C2C | C2D | H40 | 142.8° | 180.0° |
H38 | C2C | C2D | H41 | 97.4° | 60.0° |
H39 | C2C | C2D | H40 | 22.9° | 60.0° |
H39 | C2C | C2D | H41 | 142.7° | 179.9° |
H40 | C2D | C2E | H42 | 59.9° | 179.9° |
H40 | C2D | C2E | H43 | 60.1° | 60.1° |
H40 | C2D | C2E | H44 | 179.9° | 60.0° |
H41 | C2D | C2E | H42 | 59.9° | 60.0° |
H41 | C2D | C2E | H43 | 179.9° | 180.0° |
H41 | C2D | C2E | H44 | 60.1° | 60.0° |
H42 | C2E | H43 | H44 | 120.0° | 120.0° |
H47 | C32 | C33 | H49 | 159.8° | 180.0° |
H47 | C32 | C33 | H50 | 38.7° | 60.0° |
H48 | C32 | C33 | H49 | 80.7° | 60.1° |
H48 | C32 | C33 | H50 | 158.3° | 179.9° |
H49 | C33 | C34 | H51 | 170.0° | 180.0° |
H49 | C33 | C34 | H52 | 50.1° | 60.0° |
H50 | C33 | C34 | H51 | 69.0° | 60.0° |
H50 | C33 | C34 | H52 | 171.1° | NaN° |
H51 | C34 | C35 | H53 | 156.5° | 180.0° |
H51 | C34 | C35 | H54 | 82.9° | 60.0° |
H52 | C34 | C35 | H53 | 36.6° | 60.0° |
H52 | C34 | C35 | H54 | 157.2° | 180.0° |
H53 | C35 | C36 | H55 | 169.9° | 180.0° |
H53 | C35 | C36 | H56 | 70.0° | 60.0° |
H54 | C35 | C36 | H55 | 49.4° | 60.0° |
H54 | C35 | C36 | H56 | 169.4° | 180.0° |
H55 | C36 | C37 | H57 | 160.1° | 180.0° |
H55 | C36 | C37 | H58 | 79.7° | 60.0° |
H56 | C36 | C37 | H57 | 40.0° | 60.0° |
H56 | C36 | C37 | H58 | 160.3° | 180.0° |
H57 | C37 | C38 | H59 | 62.4° | 180.0° |
H57 | C37 | C38 | H60 | 177.8° | 60.0° |
H58 | C37 | C38 | H59 | 57.9° | 60.0° |
H58 | C37 | C38 | H60 | 62.0° | 180.0° |
H59 | C38 | C39 | H61 | 171.6° | 180.0° |
H59 | C38 | C39 | H62 | 51.4° | 60.0° |
H60 | C38 | C39 | H61 | 68.6° | 60.0° |
H60 | C38 | C39 | H62 | 171.2° | 180.0° |
H61 | C39 | C3A | H63 | 138.3° | 179.9° |
H61 | C39 | C3A | H64 | 18.4° | 59.9° |
H62 | C39 | C3A | H63 | 101.5° | 60.0° |
H62 | C39 | C3A | H64 | 138.6° | 180.0° |
H63 | C3A | C3B | H65 | 59.9° | 180.0° |
H63 | C3A | C3B | H66 | 60.1° | 60.0° |
H63 | C3A | C3B | H67 | 179.9° | 60.0° |
H64 | C3A | C3B | H65 | 60.0° | 60.0° |
H64 | C3A | C3B | H66 | 179.9° | 180.0° |
H64 | C3A | C3B | H67 | 60.1° | 60.0° |
H65 | C3B | H66 | H67 | 120.0° | 120.0° |