AG7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.51Å | 1.54Å | |
| C01 | O03 | doub | 1.21Å | 1.23Å | |
| C01 | C57 | sing | 1.51Å | 1.55Å | |
| C02 | C04 | sing | 1.53Å | 1.53Å | |
| C02 | H2 | sing | 1.09Å | 1.10Å | |
| C02 | H3 | sing | 1.09Å | 1.10Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C04 | C47 | sing | 1.51Å | 1.52Å | |
| C04 | H27 | sing | 1.09Å | 1.10Å | |
| C05 | C06 | sing | 1.51Å | 1.45Å | |
| C05 | H28 | sing | 1.09Å | 1.10Å | |
| C05 | H29 | sing | 1.09Å | 1.10Å | |
| C06 | C07 | doub | 1.38Å | 1.40Å | Aromatic |
| C06 | C11 | sing | 1.38Å | 1.38Å | Aromatic |
| C07 | C08 | sing | 1.38Å | 1.39Å | Aromatic |
| C07 | H30 | sing | 1.08Å | 1.08Å | |
| C08 | C09 | doub | 1.38Å | 1.39Å | Aromatic |
| C08 | H31 | sing | 1.08Å | 1.08Å | |
| C09 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C09 | F1 | sing | 1.35Å | 1.33Å | |
| C10 | C11 | doub | 1.38Å | 1.41Å | Aromatic |
| C10 | H33 | sing | 1.08Å | 1.08Å | |
| C11 | H34 | sing | 1.08Å | 1.08Å | |
| N12 | C13 | sing | 1.47Å | 1.47Å | |
| N12 | C47 | sing | 1.35Å | 1.32Å | |
| N12 | H49 | sing | 0.97Å | 1.00Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | C19 | sing | 1.53Å | 1.57Å | |
| C13 | H91 | sing | 1.09Å | 1.10Å | |
| C14 | C15 | sing | 1.53Å | 1.54Å | |
| C14 | H35 | sing | 1.09Å | 1.10Å | |
| C14 | H36 | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.51Å | 1.50Å | |
| C15 | C84 | sing | 1.55Å | 1.54Å | |
| C15 | H94 | sing | 1.09Å | 1.10Å | |
| C16 | N17 | sing | 1.35Å | 1.30Å | |
| C16 | O18 | doub | 1.21Å | 1.22Å | |
| N17 | C83 | sing | 1.47Å | 1.47Å | |
| N17 | H39 | sing | 0.97Å | 1.00Å | |
| C19 | C20 | sing | 1.53Å | 1.56Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C20 | C21 | sing | 1.51Å | 1.55Å | |
| C20 | H41 | sing | 1.09Å | 1.10Å | |
| C20 | H42 | sing | 1.09Å | 1.10Å | |
| C21 | O22 | sing | 1.34Å | 1.32Å | |
| C21 | O23 | doub | 1.21Å | 1.22Å | |
| O22 | C50 | sing | 1.45Å | 1.45Å | |
| C47 | O48 | doub | 1.21Å | 1.23Å | |
| C50 | C53 | sing | 1.53Å | 1.54Å | |
| C50 | H51 | sing | 1.09Å | 1.10Å | |
| C50 | H52 | sing | 1.09Å | 1.10Å | |
| C53 | H53 | sing | 1.09Å | 1.10Å | |
| C53 | H54 | sing | 1.09Å | 1.10Å | |
| C53 | H56 | sing | 1.09Å | 1.10Å | |
| C57 | N58 | sing | 1.46Å | 1.46Å | |
| C57 | C78 | sing | 1.53Å | 1.55Å | |
| C57 | H77 | sing | 1.09Å | 1.10Å | |
| N58 | C59 | sing | 1.35Å | 1.31Å | |
| N58 | H61 | sing | 0.97Å | 1.00Å | |
| C59 | O60 | doub | 1.22Å | 1.22Å | |
| C59 | C1 | sing | 1.48Å | 1.39Å | |
| C78 | C81 | sing | 1.53Å | 1.54Å | |
| C78 | C82 | sing | 1.53Å | 1.53Å | |
| C78 | H79 | sing | 1.09Å | 1.10Å | |
| C81 | H82 | sing | 1.09Å | 1.10Å | |
| C81 | H84 | sing | 1.09Å | 1.10Å | |
| C81 | H85 | sing | 1.09Å | 1.10Å | |
| C82 | H86 | sing | 1.09Å | 1.10Å | |
| C82 | H87 | sing | 1.09Å | 1.10Å | |
| C82 | H88 | sing | 1.09Å | 1.10Å | |
| C83 | C84 | sing | 1.54Å | 1.55Å | |
| C83 | H89 | sing | 1.09Å | 1.10Å | |
| C83 | H90 | sing | 1.09Å | 1.10Å | |
| C84 | H92 | sing | 1.09Å | 1.10Å | |
| C84 | H93 | sing | 1.09Å | 1.10Å | |
| C1 | C2 | sing | 1.42Å | 1.39Å | Aromatic |
| C1 | N5 | doub | 1.31Å | 1.34Å | Aromatic |
| C2 | C3 | doub | 1.35Å | 1.40Å | Aromatic |
| C2 | H8 | sing | 1.08Å | 1.08Å | |
| C3 | O4 | sing | 1.34Å | 1.33Å | Aromatic |
| C3 | C4 | sing | 1.51Å | 1.52Å | |
| O4 | N5 | sing | 1.21Å | 1.38Å | Aromatic |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C01 | O03 | 120.1° | 120.0° |
| C02 | C01 | C57 | 118.1° | 120.0° |
| C01 | C02 | C04 | 111.2° | 109.5° |
| C01 | C02 | H2 | 108.9° | 109.4° |
| C01 | C02 | H3 | 108.9° | 109.5° |
| O03 | C01 | C57 | 121.8° | 120.0° |
| C01 | C57 | N58 | 108.6° | 109.5° |
| C01 | C57 | C78 | 114.8° | 109.4° |
| C01 | C57 | H77 | 104.7° | 109.5° |
| C04 | C02 | H2 | 108.9° | 109.5° |
| C04 | C02 | H3 | 108.9° | 109.5° |
| C02 | C04 | C05 | 106.8° | 109.5° |
| C02 | C04 | C47 | 112.0° | 109.5° |
| C02 | C04 | H27 | 110.2° | 109.4° |
| H2 | C02 | H3 | 110.1° | 109.5° |
| C05 | C04 | C47 | 111.3° | 109.5° |
| C05 | C04 | H27 | 110.9° | 109.5° |
| C04 | C05 | C06 | 107.5° | 109.5° |
| C04 | C05 | H28 | 110.1° | 109.4° |
| C04 | C05 | H29 | 110.1° | 109.4° |
| C47 | C04 | H27 | 105.6° | 109.5° |
| C04 | C47 | N12 | 120.3° | 120.0° |
| C04 | C47 | O48 | 120.9° | 120.0° |
| C06 | C05 | H28 | 110.1° | 109.5° |
| C06 | C05 | H29 | 110.1° | 109.5° |
| C05 | C06 | C07 | 120.0° | 120.0° |
| C05 | C06 | C11 | 120.7° | 119.9° |
| H28 | C05 | H29 | 108.8° | 109.5° |
| C07 | C06 | C11 | 119.3° | 120.0° |
| C06 | C07 | C08 | 120.1° | 120.0° |
| C06 | C07 | H30 | 120.0° | 119.9° |
| C06 | C11 | C10 | 120.6° | 120.0° |
| C06 | C11 | H34 | 119.7° | 120.0° |
| C08 | C07 | H30 | 120.0° | 120.0° |
| C07 | C08 | C09 | 119.9° | 120.0° |
| C07 | C08 | H31 | 120.0° | 120.0° |
| C09 | C08 | H31 | 120.0° | 120.0° |
| C08 | C09 | C10 | 120.3° | 119.9° |
| C08 | C09 | F1 | 119.8° | 120.0° |
| C10 | C09 | F1 | 119.8° | 120.0° |
| C09 | C10 | C11 | 119.8° | 120.0° |
| C09 | C10 | H33 | 120.1° | 120.0° |
| C11 | C10 | H33 | 120.1° | 120.0° |
| C10 | C11 | H34 | 119.7° | 120.0° |
| C13 | N12 | C47 | 120.5° | 120.0° |
| C13 | N12 | H49 | 119.7° | 120.0° |
| N12 | C13 | C14 | 113.3° | 109.5° |
| N12 | C13 | C19 | 111.0° | 109.4° |
| N12 | C13 | H91 | 106.4° | 109.5° |
| C47 | N12 | H49 | 119.7° | 120.0° |
| N12 | C47 | O48 | 118.7° | 120.0° |
| C14 | C13 | C19 | 111.3° | 109.5° |
| C14 | C13 | H91 | 106.0° | 109.5° |
| C13 | C14 | C15 | 112.5° | 109.5° |
| C13 | C14 | H35 | 108.5° | 109.4° |
| C13 | C14 | H36 | 108.5° | 109.4° |
| C19 | C13 | H91 | 108.5° | 109.5° |
| C13 | C19 | C20 | 111.6° | 109.5° |
| C13 | C19 | H191 | 108.8° | 109.5° |
| C13 | C19 | H192 | 108.8° | 109.5° |
| C15 | C14 | H35 | 108.5° | 109.5° |
| C15 | C14 | H36 | 108.5° | 109.5° |
| C14 | C15 | C16 | 113.1° | 110.5° |
| C14 | C15 | C84 | 117.5° | 110.5° |
| C14 | C15 | H94 | 98.7° | 110.4° |
| H35 | C14 | H36 | 110.4° | 109.5° |
| C16 | C15 | C84 | 100.0° | 104.3° |
| C16 | C15 | H94 | 116.6° | 110.5° |
| C15 | C16 | N17 | 111.9° | 110.1° |
| C15 | C16 | O18 | 125.4° | 125.0° |
| C84 | C15 | H94 | 112.0° | 110.6° |
| C15 | C84 | C83 | 103.3° | 101.7° |
| C15 | C84 | H92 | 111.6° | 111.0° |
| C15 | C84 | H93 | 111.6° | 111.0° |
| N17 | C16 | O18 | 122.5° | 124.9° |
| C16 | N17 | C83 | 111.6° | 111.3° |
| C16 | N17 | H39 | 124.2° | 124.3° |
| C83 | N17 | H39 | 124.2° | 124.4° |
| N17 | C83 | C84 | 103.2° | 105.5° |
| N17 | C83 | H89 | 111.6° | 110.2° |
| N17 | C83 | H90 | 111.6° | 110.2° |
| C20 | C19 | H191 | 108.8° | 109.5° |
| C20 | C19 | H192 | 108.8° | 109.5° |
| C19 | C20 | C21 | 111.7° | 109.5° |
| C19 | C20 | H41 | 108.7° | 109.4° |
| C19 | C20 | H42 | 108.7° | 109.5° |
| H191 | C19 | H192 | 110.2° | 109.4° |
| C21 | C20 | H41 | 108.7° | 109.4° |
| C21 | C20 | H42 | 108.7° | 109.5° |
| C20 | C21 | O22 | 114.2° | 120.0° |
| C20 | C21 | O23 | 122.6° | 120.0° |
| H41 | C20 | H42 | 110.2° | 109.5° |
| O22 | C21 | O23 | 123.3° | 120.0° |
| C21 | O22 | C50 | 120.2° | 117.0° |
| O22 | C50 | C53 | 108.4° | 109.5° |
| O22 | C50 | H51 | 109.8° | 109.5° |
| O22 | C50 | H52 | 109.8° | 109.4° |
| C53 | C50 | H51 | 109.8° | 109.5° |
| C53 | C50 | H52 | 109.8° | 109.5° |
| C50 | C53 | H53 | 109.5° | 109.4° |
| C50 | C53 | H54 | 109.5° | 109.5° |
| C50 | C53 | H56 | 109.5° | 109.5° |
| H51 | C50 | H52 | 109.1° | 109.4° |
| H53 | C53 | H54 | 109.4° | 109.5° |
| H53 | C53 | H56 | 109.4° | 109.5° |
| H54 | C53 | H56 | 109.5° | 109.5° |
| N58 | C57 | C78 | 103.3° | 109.5° |
| N58 | C57 | H77 | 115.9° | 109.5° |
| C57 | N58 | C59 | 121.8° | 120.0° |
| C57 | N58 | H61 | 119.1° | 120.0° |
| C78 | C57 | H77 | 109.9° | 109.5° |
| C57 | C78 | C81 | 108.0° | 109.5° |
| C57 | C78 | C82 | 118.3° | 109.4° |
| C57 | C78 | H79 | 104.6° | 109.5° |
| C59 | N58 | H61 | 119.1° | 120.0° |
| N58 | C59 | O60 | 117.3° | 120.0° |
| N58 | C59 | C1 | 117.8° | 120.0° |
| O60 | C59 | C1 | 124.8° | 120.0° |
| C59 | C1 | C2 | 120.6° | 126.9° |
| C59 | C1 | N5 | 127.5° | 126.9° |
| C81 | C78 | C82 | 110.1° | 109.4° |
| C81 | C78 | H79 | 113.7° | 109.5° |
| C78 | C81 | H82 | 109.5° | 109.5° |
| C78 | C81 | H84 | 109.4° | 109.5° |
| C78 | C81 | H85 | 109.5° | 109.4° |
| C82 | C78 | H79 | 102.2° | 109.4° |
| C78 | C82 | H86 | 109.5° | 109.4° |
| C78 | C82 | H87 | 109.4° | 109.5° |
| C78 | C82 | H88 | 109.5° | 109.5° |
| H82 | C81 | H84 | 109.5° | 109.5° |
| H82 | C81 | H85 | 109.5° | 109.5° |
| H84 | C81 | H85 | 109.5° | 109.4° |
| H86 | C82 | H87 | 109.5° | 109.5° |
| H86 | C82 | H88 | 109.4° | 109.5° |
| H87 | C82 | H88 | 109.5° | 109.5° |
| C84 | C83 | H89 | 111.6° | 110.2° |
| C84 | C83 | H90 | 111.6° | 110.2° |
| C83 | C84 | H92 | 111.6° | 111.0° |
| C83 | C84 | H93 | 111.6° | 111.0° |
| H89 | C83 | H90 | 107.3° | 110.4° |
| H92 | C84 | H93 | 107.2° | 110.9° |
| C2 | C1 | N5 | 111.8° | 106.2° |
| C1 | C2 | C3 | 102.8° | 103.9° |
| C1 | C2 | H8 | 128.6° | 128.1° |
| C1 | N5 | O4 | 106.6° | 111.4° |
| C3 | C2 | H8 | 128.6° | 128.0° |
| C2 | C3 | O4 | 110.6° | 106.6° |
| C2 | C3 | C4 | 128.0° | 126.7° |
| O4 | C3 | C4 | 121.4° | 126.7° |
| C3 | O4 | N5 | 108.2° | 111.9° |
| C3 | C4 | H5 | 109.5° | 109.4° |
| C3 | C4 | H6 | 109.5° | 109.5° |
| C3 | C4 | H7 | 109.5° | 109.5° |
| H5 | C4 | H6 | 109.4° | 109.5° |
| H5 | C4 | H7 | 109.5° | 109.4° |
| H6 | C4 | H7 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C01 | O03 | C57 | 178.2° | 179.8° |
| C01 | C02 | C04 | H2 | 120.0° | 120.0° |
| C01 | C02 | C04 | H3 | 120.0° | 120.0° |
| C01 | C02 | H2 | H3 | 119.3° | 120.0° |
| C01 | C02 | C04 | C05 | 169.9° | 65.0° |
| C01 | C02 | C04 | C47 | 68.0° | 175.0° |
| C01 | C02 | C04 | H27 | 49.3° | 55.0° |
| C02 | C01 | C57 | N58 | 158.2° | 76.3° |
| C02 | C01 | C57 | C78 | 86.8° | 163.7° |
| C02 | C01 | C57 | H77 | 33.8° | 43.8° |
| O03 | C01 | C02 | C04 | 3.9° | 0.4° |
| O03 | C01 | C02 | H2 | 116.1° | 120.4° |
| O03 | C01 | C02 | H3 | 123.9° | 119.6° |
| O03 | C01 | C57 | N58 | 20.1° | 104.0° |
| O03 | C01 | C57 | C78 | 95.0° | 16.0° |
| O03 | C01 | C57 | H77 | 144.5° | 136.0° |
| C57 | C01 | C02 | C04 | 177.8° | 179.8° |
| C57 | C01 | C02 | H2 | 62.2° | 59.8° |
| C57 | C01 | C02 | H3 | 57.8° | 60.2° |
| C01 | C57 | N58 | C78 | 122.3° | 120.0° |
| C01 | C57 | N58 | H77 | 117.4° | 120.0° |
| C01 | C57 | C78 | H77 | 117.6° | 120.0° |
| C01 | C57 | N58 | C59 | 109.1° | 155.0° |
| C01 | C57 | N58 | H61 | 71.0° | 25.0° |
| C01 | C57 | C78 | C81 | 151.5° | 63.9° |
| C01 | C57 | C78 | C82 | 25.7° | 176.2° |
| C01 | C57 | C78 | H79 | 87.1° | 56.2° |
| C04 | C02 | H2 | H3 | 119.3° | 120.0° |
| C02 | C04 | C05 | C47 | 122.5° | 120.0° |
| C02 | C04 | C05 | H27 | 120.2° | 120.0° |
| C02 | C04 | C47 | H27 | 120.0° | 120.0° |
| C02 | C04 | C05 | C06 | 77.1° | 173.4° |
| C02 | C04 | C05 | H28 | 42.9° | 53.5° |
| C02 | C04 | C05 | H29 | 162.9° | 66.5° |
| C02 | C04 | C47 | N12 | 134.2° | 159.5° |
| C02 | C04 | C47 | O48 | 43.1° | 20.4° |
| H2 | C02 | C04 | C05 | 49.9° | 55.0° |
| H2 | C02 | C04 | C47 | 172.0° | 65.0° |
| H2 | C02 | C04 | H27 | 70.7° | 175.0° |
| H3 | C02 | C04 | C05 | 70.2° | 175.0° |
| H3 | C02 | C04 | C47 | 51.9° | 55.0° |
| H3 | C02 | C04 | H27 | 169.2° | 65.0° |
| C05 | C04 | C47 | H27 | 120.5° | 120.0° |
| C04 | C05 | C06 | H28 | 120.0° | 119.9° |
| C04 | C05 | C06 | H29 | 120.0° | 120.0° |
| C04 | C05 | H28 | H29 | 120.8° | 119.9° |
| C04 | C05 | C06 | C07 | 61.4° | 83.7° |
| C04 | C05 | C06 | C11 | 116.9° | 96.6° |
| C05 | C04 | C47 | N12 | 106.3° | 80.4° |
| C05 | C04 | C47 | O48 | 76.4° | 99.6° |
| C47 | C04 | C05 | C06 | 160.4° | 66.5° |
| C47 | C04 | C05 | H28 | 79.6° | 173.5° |
| C47 | C04 | C05 | H29 | 40.4° | 53.5° |
| C04 | C47 | N12 | C13 | 178.6° | 174.5° |
| C04 | C47 | N12 | O48 | 177.3° | 180.0° |
| C04 | C47 | N12 | H49 | 1.4° | 5.4° |
| H27 | C04 | C05 | C06 | 43.0° | 53.4° |
| H27 | C04 | C05 | H28 | 163.1° | 66.5° |
| H27 | C04 | C05 | H29 | 77.0° | 173.5° |
| H27 | C04 | C47 | N12 | 14.1° | 39.6° |
| H27 | C04 | C47 | O48 | 163.1° | 140.4° |
| C06 | C05 | H28 | H29 | 120.8° | 120.1° |
| C05 | C06 | C07 | C11 | 178.3° | 179.7° |
| C05 | C06 | C07 | C08 | 179.6° | 180.0° |
| C05 | C06 | C07 | H30 | 0.4° | 0.0° |
| C05 | C06 | C11 | C10 | 179.7° | 179.7° |
| C05 | C06 | C11 | H34 | 0.3° | 0.0° |
| H28 | C05 | C06 | C07 | 178.6° | 36.3° |
| H28 | C05 | C06 | C11 | 3.1° | 143.5° |
| H29 | C05 | C06 | C07 | 58.6° | 156.3° |
| H29 | C05 | C06 | C11 | 123.1° | 23.4° |
| C06 | C07 | C08 | H30 | 180.0° | 180.0° |
| C06 | C07 | C08 | C09 | 0.7° | 0.0° |
| C06 | C07 | C08 | H31 | 179.3° | 180.0° |
| C07 | C06 | C11 | C10 | 1.4° | 0.5° |
| C07 | C06 | C11 | H34 | 178.6° | 179.8° |
| C11 | C06 | C07 | C08 | 1.2° | 0.2° |
| C11 | C06 | C07 | H30 | 178.7° | 179.8° |
| C06 | C11 | C10 | C09 | 1.0° | 0.5° |
| C06 | C11 | C10 | H34 | 180.0° | 179.7° |
| C06 | C11 | C10 | H33 | 179.0° | 179.7° |
| C07 | C08 | C09 | H31 | 180.0° | 180.0° |
| C07 | C08 | C09 | C10 | 0.3° | 0.0° |
| C07 | C08 | C09 | F1 | 178.2° | 180.0° |
| H30 | C07 | C08 | C09 | 179.3° | 179.9° |
| H30 | C07 | C08 | H31 | 0.7° | 0.0° |
| C08 | C09 | C10 | F1 | 177.9° | 180.0° |
| C08 | C09 | C10 | C11 | 0.4° | 0.2° |
| C08 | C09 | C10 | H33 | 179.5° | 180.0° |
| H31 | C08 | C09 | C10 | 179.7° | 180.0° |
| H31 | C08 | C09 | F1 | 1.9° | 0.0° |
| C09 | C10 | C11 | H33 | 180.0° | 179.8° |
| C09 | C10 | C11 | H34 | 179.0° | 179.8° |
| F1 | C09 | C10 | C11 | 178.3° | 179.8° |
| F1 | C09 | C10 | H33 | 1.7° | 0.0° |
| H33 | C10 | C11 | H34 | 1.0° | 0.0° |
| C13 | N12 | C47 | H49 | 180.0° | 180.0° |
| N12 | C13 | C14 | C19 | 125.9° | 120.0° |
| N12 | C13 | C14 | H91 | 116.3° | 120.0° |
| N12 | C13 | C19 | H91 | 116.6° | 119.9° |
| N12 | C13 | C14 | C15 | 68.0° | 67.3° |
| N12 | C13 | C14 | H35 | 51.9° | 52.6° |
| N12 | C13 | C14 | H36 | 171.9° | 172.6° |
| N12 | C13 | C19 | C20 | 68.6° | 66.3° |
| N12 | C13 | C19 | H191 | 171.4° | 173.7° |
| N12 | C13 | C19 | H192 | 51.4° | 53.7° |
| C13 | N12 | C47 | O48 | 4.0° | 5.4° |
| C47 | N12 | C13 | C14 | 115.0° | 153.1° |
| C47 | N12 | C13 | C19 | 118.9° | 86.9° |
| C47 | N12 | C13 | H91 | 1.1° | 33.1° |
| H49 | N12 | C13 | C14 | 65.0° | 26.9° |
| H49 | N12 | C13 | C19 | 61.1° | 93.2° |
| H49 | N12 | C13 | H91 | 178.9° | 146.9° |
| H49 | N12 | C47 | O48 | 176.0° | 174.6° |
| C14 | C13 | C19 | H91 | 116.3° | 120.0° |
| C13 | C14 | C15 | H35 | 120.0° | 119.9° |
| C13 | C14 | C15 | H36 | 120.0° | 120.0° |
| C13 | C14 | H35 | H36 | 118.8° | 119.9° |
| C13 | C14 | C15 | C16 | 177.2° | 67.4° |
| C13 | C14 | C15 | C84 | 61.5° | 177.8° |
| C13 | C14 | C15 | H94 | 59.0° | 55.1° |
| C14 | C13 | C19 | C20 | 164.2° | 173.7° |
| C14 | C13 | C19 | H191 | 44.3° | 53.7° |
| C14 | C13 | C19 | H192 | 75.8° | 66.3° |
| C19 | C13 | C14 | C15 | 166.0° | 172.7° |
| C19 | C13 | C14 | H35 | 74.0° | 67.4° |
| C19 | C13 | C14 | H36 | 46.0° | 52.6° |
| C13 | C19 | C20 | H191 | 120.0° | 120.0° |
| C13 | C19 | C20 | H192 | 120.0° | 120.0° |
| C13 | C19 | H191 | H192 | 119.2° | 120.0° |
| C13 | C19 | C20 | C21 | 136.8° | 178.8° |
| C13 | C19 | C20 | H41 | 103.2° | 58.9° |
| C13 | C19 | C20 | H42 | 16.8° | 61.1° |
| H91 | C13 | C14 | C15 | 48.2° | 52.7° |
| H91 | C13 | C14 | H35 | 168.2° | 172.6° |
| H91 | C13 | C14 | H36 | 71.8° | 67.4° |
| H91 | C13 | C19 | C20 | 48.0° | 53.6° |
| H91 | C13 | C19 | H191 | 72.0° | 66.4° |
| H91 | C13 | C19 | H192 | 168.0° | 173.7° |
| C15 | C14 | H35 | H36 | 118.7° | 120.1° |
| C14 | C15 | C16 | C84 | 125.7° | 118.7° |
| C14 | C15 | C16 | H94 | 113.3° | 122.4° |
| C14 | C15 | C84 | H94 | 113.2° | 122.5° |
| C14 | C15 | C16 | N17 | 154.1° | 102.5° |
| C14 | C15 | C16 | O18 | 21.7° | 77.6° |
| C14 | C15 | C84 | C83 | 152.8° | 93.9° |
| C14 | C15 | C84 | H92 | 32.7° | 24.2° |
| C14 | C15 | C84 | H93 | 87.2° | 148.0° |
| H35 | C14 | C15 | C16 | 62.8° | 52.5° |
| H35 | C14 | C15 | C84 | 178.5° | 62.3° |
| H35 | C14 | C15 | H94 | 61.0° | 175.0° |
| H36 | C14 | C15 | C16 | 57.2° | 172.6° |
| H36 | C14 | C15 | C84 | 58.5° | 57.8° |
| H36 | C14 | C15 | H94 | 179.0° | 64.9° |
| C16 | C15 | C84 | H94 | 124.1° | 118.8° |
| C15 | C16 | N17 | O18 | 175.9° | 179.9° |
| C15 | C16 | N17 | C83 | 14.0° | 0.4° |
| C15 | C16 | N17 | H39 | 166.1° | 179.6° |
| C16 | C15 | C84 | C83 | 30.1° | 24.8° |
| C16 | C15 | C84 | H92 | 89.9° | 142.9° |
| C16 | C15 | C84 | H93 | 150.1° | 93.3° |
| C84 | C15 | C16 | N17 | 28.4° | 16.2° |
| C84 | C15 | C16 | O18 | 147.4° | 163.7° |
| C15 | C84 | C83 | N17 | 23.8° | 25.4° |
| C15 | C84 | C83 | H92 | 120.0° | 118.1° |
| C15 | C84 | C83 | H93 | 120.0° | 118.1° |
| C15 | C84 | C83 | H89 | 96.2° | 144.4° |
| C15 | C84 | C83 | H90 | 143.8° | 93.5° |
| C15 | C84 | H92 | H93 | 122.5° | 123.9° |
| H94 | C15 | C16 | N17 | 92.5° | 135.1° |
| H94 | C15 | C16 | O18 | 91.7° | 44.8° |
| H94 | C15 | C84 | C83 | 94.0° | 143.6° |
| H94 | C15 | C84 | H92 | 145.9° | 98.3° |
| H94 | C15 | C84 | H93 | 26.0° | 25.5° |
| C16 | N17 | C83 | H39 | 180.0° | 180.0° |
| C16 | N17 | C83 | C84 | 7.0° | 17.1° |
| C16 | N17 | C83 | H89 | 113.0° | 136.0° |
| C16 | N17 | C83 | H90 | 127.0° | 101.9° |
| O18 | C16 | N17 | C83 | 162.0° | 179.6° |
| O18 | C16 | N17 | H39 | 18.0° | 0.3° |
| N17 | C83 | C84 | H89 | 120.0° | 118.9° |
| N17 | C83 | C84 | H90 | 120.0° | 119.0° |
| N17 | C83 | H89 | H90 | 122.6° | 122.0° |
| N17 | C83 | C84 | H92 | 96.2° | 143.5° |
| N17 | C83 | C84 | H93 | 143.8° | 92.7° |
| H39 | N17 | C83 | C84 | 173.0° | 163.0° |
| H39 | N17 | C83 | H89 | 67.0° | 44.0° |
| H39 | N17 | C83 | H90 | 53.0° | 78.0° |
| C20 | C19 | H191 | H192 | 119.1° | 120.0° |
| C19 | C20 | C21 | H41 | 120.0° | 120.0° |
| C19 | C20 | C21 | H42 | 120.0° | 120.0° |
| C19 | C20 | H41 | H42 | 119.1° | 120.0° |
| C19 | C20 | C21 | O22 | 177.8° | 180.0° |
| C19 | C20 | C21 | O23 | 3.9° | 0.0° |
| H191 | C19 | C20 | C21 | 16.8° | 61.2° |
| H191 | C19 | C20 | H41 | 136.8° | 178.9° |
| H191 | C19 | C20 | H42 | 103.2° | 58.9° |
| H192 | C19 | C20 | C21 | 103.2° | 58.8° |
| H192 | C19 | C20 | H41 | 16.8° | 61.2° |
| H192 | C19 | C20 | H42 | 136.8° | 178.8° |
| C21 | C20 | H41 | H42 | 119.1° | 120.0° |
| C20 | C21 | O22 | O23 | 178.3° | 179.9° |
| C20 | C21 | O22 | C50 | 174.7° | 180.0° |
| H41 | C20 | C21 | O22 | 57.8° | 60.1° |
| H41 | C20 | C21 | O23 | 123.9° | 120.0° |
| H42 | C20 | C21 | O22 | 62.2° | 59.9° |
| H42 | C20 | C21 | O23 | 116.1° | 120.0° |
| C21 | O22 | C50 | C53 | 158.0° | 180.0° |
| C21 | O22 | C50 | H51 | 38.1° | 60.0° |
| C21 | O22 | C50 | H52 | 81.9° | 60.0° |
| O23 | C21 | O22 | C50 | 3.6° | 0.0° |
| O22 | C50 | C53 | H51 | 120.0° | 120.1° |
| O22 | C50 | C53 | H52 | 120.0° | 120.0° |
| O22 | C50 | H51 | H52 | 120.4° | 119.9° |
| O22 | C50 | C53 | H53 | 180.0° | 60.0° |
| O22 | C50 | C53 | H54 | 60.0° | 60.0° |
| O22 | C50 | C53 | H56 | 60.0° | 179.9° |
| C53 | C50 | H51 | H52 | 120.5° | 120.0° |
| C50 | C53 | H53 | H54 | 120.0° | 120.0° |
| C50 | C53 | H53 | H56 | 120.0° | 120.0° |
| C50 | C53 | H54 | H56 | 120.0° | 120.0° |
| H51 | C50 | C53 | H53 | 60.0° | 180.0° |
| H51 | C50 | C53 | H54 | 180.0° | 60.1° |
| H51 | C50 | C53 | H56 | 60.0° | 60.0° |
| H52 | C50 | C53 | H53 | 60.0° | 60.0° |
| H52 | C50 | C53 | H54 | 60.0° | 179.9° |
| H52 | C50 | C53 | H56 | 180.0° | 60.0° |
| H53 | C53 | H54 | H56 | 119.9° | 120.0° |
| N58 | C57 | C78 | H77 | 124.3° | 120.1° |
| C57 | N58 | C59 | H61 | 180.0° | 180.0° |
| C57 | N58 | C59 | O60 | 0.1° | 0.0° |
| C57 | N58 | C59 | C1 | 177.4° | 180.0° |
| N58 | C57 | C78 | C81 | 90.4° | 176.2° |
| N58 | C57 | C78 | C82 | 143.8° | 56.2° |
| N58 | C57 | C78 | H79 | 31.0° | 63.7° |
| C78 | C57 | N58 | C59 | 128.6° | 85.0° |
| C78 | C57 | N58 | H61 | 51.4° | 94.9° |
| C57 | C78 | C81 | C82 | 130.5° | 119.9° |
| C57 | C78 | C81 | H79 | 115.6° | 120.1° |
| C57 | C78 | C82 | H79 | 114.1° | 120.0° |
| C57 | C78 | C81 | H82 | 180.0° | 64.1° |
| C57 | C78 | C81 | H84 | 60.0° | 175.9° |
| C57 | C78 | C81 | H85 | 60.0° | 55.9° |
| C57 | C78 | C82 | H86 | 180.0° | 60.0° |
| C57 | C78 | C82 | H87 | 60.0° | 180.0° |
| C57 | C78 | C82 | H88 | 60.0° | 60.0° |
| H77 | C57 | N58 | C59 | 8.4° | 35.0° |
| H77 | C57 | N58 | H61 | 171.6° | 145.1° |
| H77 | C57 | C78 | C81 | 33.8° | 56.1° |
| H77 | C57 | C78 | C82 | 92.0° | 63.8° |
| H77 | C57 | C78 | H79 | 155.2° | 176.2° |
| N58 | C59 | O60 | C1 | 177.0° | 180.0° |
| N58 | C59 | C1 | C2 | 169.9° | 180.0° |
| N58 | C59 | C1 | N5 | 5.7° | 0.3° |
| H61 | N58 | C59 | O60 | 179.9° | 179.9° |
| H61 | N58 | C59 | C1 | 2.7° | 0.0° |
| O60 | C59 | C1 | C2 | 7.1° | 0.0° |
| O60 | C59 | C1 | N5 | 177.3° | 179.7° |
| C59 | C1 | C2 | N5 | 176.2° | 179.7° |
| C59 | C1 | C2 | C3 | 174.9° | 180.0° |
| C59 | C1 | C2 | H8 | 5.1° | 0.0° |
| C59 | C1 | N5 | O4 | 173.7° | 179.8° |
| C81 | C78 | C82 | H79 | 121.1° | 120.0° |
| C78 | C81 | H82 | H84 | 120.0° | 120.0° |
| C78 | C81 | H82 | H85 | 120.0° | 120.0° |
| C78 | C81 | H84 | H85 | 120.0° | 119.9° |
| C81 | C78 | C82 | H86 | 55.2° | 180.0° |
| C81 | C78 | C82 | H87 | 175.2° | 60.0° |
| C81 | C78 | C82 | H88 | 64.7° | 60.0° |
| C82 | C78 | C81 | H82 | 49.5° | 55.8° |
| C82 | C78 | C81 | H84 | 70.5° | 64.2° |
| C82 | C78 | C81 | H85 | 169.5° | 175.9° |
| C78 | C82 | H86 | H87 | 120.0° | 120.0° |
| C78 | C82 | H86 | H88 | 120.0° | 120.0° |
| C78 | C82 | H87 | H88 | 120.0° | 120.0° |
| H79 | C78 | C81 | H82 | 64.4° | 175.8° |
| H79 | C78 | C81 | H84 | 175.6° | 55.8° |
| H79 | C78 | C81 | H85 | 55.6° | 64.2° |
| H79 | C78 | C82 | H86 | 65.9° | 60.0° |
| H79 | C78 | C82 | H87 | 54.1° | 60.0° |
| H79 | C78 | C82 | H88 | 174.1° | 180.0° |
| H82 | C81 | H84 | H85 | 120.0° | 120.0° |
| H86 | C82 | H87 | H88 | 120.0° | 120.0° |
| C84 | C83 | H89 | H90 | 122.5° | 122.0° |
| C83 | C84 | H92 | H93 | 122.5° | 123.8° |
| H89 | C83 | C84 | H92 | 143.8° | 97.5° |
| H89 | C83 | C84 | H93 | 23.8° | 26.3° |
| H90 | C83 | C84 | H92 | 23.8° | 24.6° |
| H90 | C83 | C84 | H93 | 96.2° | 148.4° |
| C1 | C2 | C3 | H8 | 180.0° | 180.0° |
| C1 | C2 | C3 | O4 | 0.2° | 0.0° |
| C1 | C2 | C3 | C4 | 178.3° | 180.0° |
| C2 | C1 | N5 | O4 | 2.2° | 0.5° |
| N5 | C1 | C2 | C3 | 1.3° | 0.3° |
| N5 | C1 | C2 | H8 | 178.7° | 179.8° |
| C1 | N5 | O4 | C3 | 2.2° | 0.5° |
| C2 | C3 | O4 | C4 | 178.6° | 180.0° |
| C2 | C3 | O4 | N5 | 1.5° | 0.3° |
| C2 | C3 | C4 | H5 | 178.4° | 90.0° |
| C2 | C3 | C4 | H6 | 58.4° | 150.0° |
| C2 | C3 | C4 | H7 | 61.6° | 29.9° |
| H8 | C2 | C3 | O4 | 179.8° | 180.0° |
| H8 | C2 | C3 | C4 | 1.7° | 0.0° |
| O4 | C3 | C4 | H5 | 0.0° | 90.1° |
| O4 | C3 | C4 | H6 | 120.0° | 29.9° |
| O4 | C3 | C4 | H7 | 120.0° | 150.0° |
| C4 | C3 | O4 | N5 | 177.1° | 179.8° |
| C3 | C4 | H5 | H6 | 120.0° | 120.0° |
| C3 | C4 | H5 | H7 | 120.0° | 120.0° |
| C3 | C4 | H6 | H7 | 120.0° | 120.1° |
| H5 | C4 | H6 | H7 | 120.0° | 120.0° |
