P74
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C04 | sing | 1.43Å | 1.43Å | |
| C01 | C02 | sing | 1.40Å | 1.40Å | Aromatic |
| C01 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| C04 | C05 | trip | 1.17Å | 1.20Å | |
| C05 | C06 | sing | 1.47Å | 1.46Å | |
| C06 | N | sing | 1.46Å | 1.44Å | |
| N | C07 | sing | 1.35Å | 1.36Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C1 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C7 | doub | 1.39Å | 1.42Å | Aromatic |
| N1 | C2 | sing | 1.47Å | 1.49Å | |
| N1 | C03 | sing | 1.47Å | 1.50Å | |
| N1 | C16 | sing | 1.47Å | 1.50Å | |
| O1 | C7 | sing | 1.36Å | 1.36Å | |
| C02 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| N2 | C10 | sing | 1.47Å | 1.54Å | |
| N2 | C11 | sing | 1.47Å | 1.53Å | |
| N2 | C13 | sing | 1.47Å | 1.52Å | |
| C03 | C8 | sing | 1.53Å | 1.51Å | |
| C4 | C7 | sing | 1.39Å | 1.40Å | Aromatic |
| C4 | I2 | sing | 2.09Å | 2.13Å | |
| C8 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | C15 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C07 | O01 | sing | 1.35Å | 1.36Å | |
| C07 | O | doub | 1.22Å | 1.22Å | |
| O01 | C08 | sing | 1.45Å | 1.46Å | |
| C08 | C09 | sing | 1.53Å | 1.54Å | |
| C08 | C17 | sing | 1.53Å | 1.53Å | |
| C08 | C | sing | 1.53Å | 1.53Å | |
| C02 | H02 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| N | H | sing | 0.97Å | 1.00Å | |
| C2 | H21C | sing | 1.09Å | 1.10Å | |
| C2 | H22C | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C8 | H81C | sing | 1.09Å | 1.10Å | |
| C8 | H82C | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H123 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H143 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C09 | H093 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H173 | sing | 1.09Å | 1.10Å | |
| C | HC1 | sing | 1.09Å | 1.10Å | |
| C | HC2 | sing | 1.09Å | 1.10Å | |
| C | HC3 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C04 | C01 | C02 | 122.4° | 120.1° |
| C04 | C01 | C3 | 116.2° | 120.1° |
| C01 | C04 | C05 | 178.9° | 179.9° |
| C02 | C01 | C3 | 121.5° | 119.9° |
| C01 | C02 | C4 | 116.9° | 119.9° |
| C01 | C02 | H02 | 121.6° | 120.1° |
| C01 | C3 | C1 | 120.3° | 119.9° |
| C01 | C3 | H3 | 119.8° | 120.1° |
| C04 | C05 | C06 | 179.7° | 179.9° |
| C05 | C06 | N | 108.0° | 109.5° |
| C05 | C06 | H061 | 109.9° | 109.5° |
| C05 | C06 | H062 | 109.8° | 109.5° |
| C06 | N | C07 | 121.2° | 120.0° |
| N | C06 | H061 | 109.8° | 109.5° |
| N | C06 | H062 | 109.9° | 109.5° |
| C06 | N | H | 119.4° | 120.0° |
| N | C07 | O01 | 108.5° | 120.0° |
| N | C07 | O | 124.7° | 119.9° |
| C07 | N | H | 119.4° | 120.0° |
| C2 | C1 | C3 | 117.9° | 119.9° |
| C2 | C1 | C7 | 121.9° | 120.0° |
| C1 | C2 | N1 | 113.4° | 109.5° |
| C1 | C2 | H21C | 108.5° | 109.5° |
| C1 | C2 | H22C | 108.5° | 109.4° |
| C3 | C1 | C7 | 120.2° | 120.1° |
| C1 | C3 | H3 | 119.8° | 120.0° |
| C1 | C7 | O1 | 120.5° | 119.9° |
| C1 | C7 | C4 | 117.5° | 120.2° |
| C2 | N1 | C03 | 112.1° | 111.0° |
| C2 | N1 | C16 | 110.7° | 111.0° |
| N1 | C2 | H21C | 108.5° | 109.5° |
| N1 | C2 | H22C | 108.4° | 109.5° |
| C03 | N1 | C16 | 111.4° | 111.2° |
| N1 | C03 | C8 | 107.2° | 109.5° |
| N1 | C03 | H031 | 110.0° | 109.5° |
| N1 | C03 | H032 | 110.0° | 109.5° |
| N1 | C16 | C15 | 111.6° | 109.6° |
| N1 | C16 | H161 | 108.9° | 109.5° |
| N1 | C16 | H162 | 108.9° | 109.5° |
| O1 | C7 | C4 | 122.1° | 119.9° |
| C7 | O1 | H1 | 109.5° | 114.0° |
| C02 | C4 | C7 | 123.7° | 120.1° |
| C02 | C4 | I2 | 119.5° | 120.0° |
| C4 | C02 | H02 | 121.6° | 120.0° |
| C10 | N2 | C11 | 113.4° | 111.0° |
| C10 | N2 | C13 | 117.3° | 111.0° |
| N2 | C10 | C8 | 108.2° | 109.5° |
| N2 | C10 | C15 | 107.7° | 109.5° |
| N2 | C10 | H10 | 110.0° | 109.5° |
| C11 | N2 | C13 | 111.0° | 111.0° |
| N2 | C11 | C12 | 107.8° | 109.5° |
| N2 | C11 | H111 | 109.9° | 109.5° |
| N2 | C11 | H112 | 109.9° | 109.5° |
| N2 | C13 | C14 | 113.5° | 109.5° |
| N2 | C13 | H131 | 108.5° | 109.4° |
| N2 | C13 | H132 | 108.5° | 109.5° |
| C03 | C8 | C10 | 109.6° | 109.3° |
| C8 | C03 | H031 | 110.0° | 109.5° |
| C8 | C03 | H032 | 110.0° | 109.4° |
| C03 | C8 | H81C | 109.4° | 109.5° |
| C03 | C8 | H82C | 109.5° | 109.5° |
| C7 | C4 | I2 | 116.8° | 120.0° |
| C8 | C10 | C15 | 110.9° | 109.1° |
| C8 | C10 | H10 | 110.1° | 109.5° |
| C10 | C8 | H81C | 109.4° | 109.5° |
| C10 | C8 | H82C | 109.5° | 109.5° |
| C10 | C15 | C16 | 108.9° | 109.3° |
| C15 | C10 | H10 | 109.9° | 109.5° |
| C10 | C15 | H151 | 109.6° | 109.5° |
| C10 | C15 | H152 | 109.6° | 109.5° |
| C12 | C11 | H111 | 109.9° | 109.5° |
| C12 | C11 | H112 | 109.9° | 109.5° |
| C11 | C12 | H121 | 109.5° | 109.4° |
| C11 | C12 | H122 | 109.5° | 109.4° |
| C11 | C12 | H123 | 109.5° | 109.5° |
| C14 | C13 | H131 | 108.4° | 109.4° |
| C14 | C13 | H132 | 108.4° | 109.5° |
| C13 | C14 | H141 | 109.5° | 109.5° |
| C13 | C14 | H142 | 109.5° | 109.5° |
| C13 | C14 | H143 | 109.5° | 109.5° |
| C15 | C16 | H161 | 108.9° | 109.5° |
| C15 | C16 | H162 | 108.9° | 109.4° |
| C16 | C15 | H151 | 109.6° | 109.5° |
| C16 | C15 | H152 | 109.6° | 109.5° |
| O01 | C07 | O | 126.8° | 120.1° |
| C07 | O01 | C08 | 120.9° | 117.0° |
| O01 | C08 | C09 | 104.8° | 109.4° |
| O01 | C08 | C17 | 111.9° | 109.4° |
| O01 | C08 | C | 110.5° | 109.5° |
| C09 | C08 | C17 | 108.1° | 109.5° |
| C09 | C08 | C | 109.1° | 109.5° |
| C08 | C09 | H091 | 109.5° | 109.5° |
| C08 | C09 | H092 | 109.5° | 109.4° |
| C08 | C09 | H093 | 109.5° | 109.5° |
| C17 | C08 | C | 112.1° | 109.5° |
| C08 | C17 | H171 | 109.5° | 109.5° |
| C08 | C17 | H172 | 109.4° | 109.4° |
| C08 | C17 | H173 | 109.4° | 109.5° |
| C08 | C | HC1 | 109.5° | 109.5° |
| C08 | C | HC2 | 109.5° | 109.5° |
| C08 | C | HC3 | 109.5° | 109.5° |
| H061 | C06 | H062 | 109.5° | 109.4° |
| H21C | C2 | H22C | 109.5° | 109.5° |
| H031 | C03 | H032 | 109.5° | 109.4° |
| H161 | C16 | H162 | 109.5° | 109.4° |
| H111 | C11 | H112 | 109.5° | 109.5° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H81C | C8 | H82C | 109.5° | 109.5° |
| H151 | C15 | H152 | 109.4° | 109.6° |
| H121 | C12 | H122 | 109.5° | 109.5° |
| H121 | C12 | H123 | 109.4° | 109.5° |
| H122 | C12 | H123 | 109.5° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.4° |
| H141 | C14 | H143 | 109.5° | 109.5° |
| H142 | C14 | H143 | 109.5° | 109.5° |
| H091 | C09 | H092 | 109.5° | 109.5° |
| H091 | C09 | H093 | 109.5° | 109.5° |
| H092 | C09 | H093 | 109.5° | 109.5° |
| H171 | C17 | H172 | 109.5° | 109.5° |
| H171 | C17 | H173 | 109.5° | 109.5° |
| H172 | C17 | H173 | 109.5° | 109.5° |
| HC1 | C | HC2 | 109.5° | 109.5° |
| HC1 | C | HC3 | 109.5° | 109.5° |
| HC2 | C | HC3 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C04 | C01 | C02 | C3 | 178.7° | 179.7° |
| C01 | C04 | C05 | C06 | 72.0° | 179.1° |
| C04 | C01 | C3 | C1 | 179.4° | 180.0° |
| C04 | C01 | C02 | C4 | 179.5° | 179.9° |
| C04 | C01 | C02 | H02 | 0.5° | 0.0° |
| C04 | C01 | C3 | H3 | 0.6° | 0.0° |
| C02 | C01 | C04 | C05 | 77.1° | 31.3° |
| C02 | C01 | C3 | C1 | 0.7° | 0.3° |
| C01 | C02 | C4 | H02 | 180.0° | 179.9° |
| C01 | C02 | C4 | C7 | 0.5° | 0.1° |
| C01 | C02 | C4 | I2 | 179.2° | 180.0° |
| C02 | C01 | C3 | H3 | 179.3° | 179.7° |
| C3 | C01 | C04 | C05 | 101.6° | 148.4° |
| C01 | C3 | C1 | C2 | 179.2° | 180.0° |
| C01 | C3 | C1 | H3 | 180.0° | 180.0° |
| C01 | C3 | C1 | C7 | 0.1° | 0.0° |
| C3 | C01 | C02 | C4 | 0.9° | 0.3° |
| C3 | C01 | C02 | H02 | 179.1° | 179.8° |
| C04 | C05 | C06 | N | 162.2° | 32.2° |
| C04 | C05 | C06 | H061 | 42.4° | 152.2° |
| C04 | C05 | C06 | H062 | 78.0° | 87.8° |
| C05 | C06 | N | H061 | 119.8° | 120.0° |
| C05 | C06 | N | H062 | 119.8° | 120.0° |
| C05 | C06 | N | C07 | 80.9° | 180.0° |
| C05 | C06 | H061 | H062 | 120.7° | 120.0° |
| C05 | C06 | N | H | 99.1° | 0.0° |
| C06 | N | C07 | H | 180.0° | 180.0° |
| C06 | N | C07 | O01 | 166.4° | 180.0° |
| C06 | N | C07 | O | 11.1° | 0.0° |
| N | C06 | H061 | H062 | 120.7° | 120.0° |
| N | C07 | O01 | O | 177.5° | 180.0° |
| N | C07 | O01 | C08 | 165.5° | 180.0° |
| C07 | N | C06 | H061 | 159.3° | 60.0° |
| C07 | N | C06 | H062 | 38.9° | 60.0° |
| C2 | C1 | C3 | C7 | 179.3° | 180.0° |
| C1 | C2 | N1 | H21C | 120.6° | 120.0° |
| C1 | C2 | N1 | H22C | 120.6° | 119.9° |
| C1 | C2 | N1 | C03 | 150.2° | 170.0° |
| C1 | C2 | N1 | C16 | 84.6° | 65.8° |
| C2 | C1 | C7 | O1 | 1.1° | 0.0° |
| C2 | C1 | C7 | C4 | 179.5° | 179.7° |
| C2 | C1 | C3 | H3 | 0.8° | 0.0° |
| C1 | C2 | H21C | H22C | 118.2° | 120.0° |
| C3 | C1 | C2 | N1 | 152.1° | 100.0° |
| C3 | C1 | C7 | O1 | 179.5° | 180.0° |
| C3 | C1 | C7 | C4 | 0.2° | 0.3° |
| C3 | C1 | C2 | H21C | 31.5° | 20.0° |
| C3 | C1 | C2 | H22C | 87.3° | 140.0° |
| C7 | C1 | C2 | N1 | 28.5° | 80.0° |
| C1 | C7 | O1 | C4 | 179.3° | 179.7° |
| C1 | C7 | C4 | C02 | 0.0° | 0.3° |
| C1 | C7 | C4 | I2 | 179.7° | 179.7° |
| C7 | C1 | C3 | H3 | 179.9° | 180.0° |
| C7 | C1 | C2 | H21C | 149.1° | 160.0° |
| C7 | C1 | C2 | H22C | 92.0° | 40.0° |
| C1 | C7 | O1 | H1 | 180.0° | 90.0° |
| C2 | N1 | C03 | C16 | 124.7° | 124.1° |
| C2 | N1 | C03 | C8 | 173.4° | 174.2° |
| C2 | N1 | C16 | C15 | 175.1° | 174.2° |
| N1 | C2 | H21C | H22C | 118.2° | 120.0° |
| C2 | N1 | C03 | H031 | 66.9° | 65.8° |
| C2 | N1 | C03 | H032 | 53.8° | 54.2° |
| C2 | N1 | C16 | H161 | 54.8° | 54.1° |
| C2 | N1 | C16 | H162 | 64.6° | 65.8° |
| N1 | C03 | C8 | H031 | 119.6° | 120.1° |
| N1 | C03 | C8 | H032 | 119.6° | 120.0° |
| N1 | C03 | C8 | C10 | 62.0° | 59.2° |
| C03 | N1 | C16 | C15 | 59.4° | 61.7° |
| C03 | N1 | C2 | H21C | 89.2° | 70.0° |
| C03 | N1 | C2 | H22C | 29.7° | 50.1° |
| N1 | C03 | H031 | H032 | 121.1° | 120.0° |
| C03 | N1 | C16 | H161 | 179.7° | 178.2° |
| C03 | N1 | C16 | H162 | 60.9° | 58.3° |
| N1 | C03 | C8 | H81C | 178.0° | 179.1° |
| N1 | C03 | C8 | H82C | 58.1° | 60.7° |
| C16 | N1 | C03 | C8 | 61.9° | 61.8° |
| N1 | C16 | C15 | C10 | 54.1° | 59.1° |
| N1 | C16 | C15 | H161 | 120.3° | 120.0° |
| N1 | C16 | C15 | H162 | 120.3° | 120.0° |
| C16 | N1 | C2 | H21C | 36.0° | 54.2° |
| C16 | N1 | C2 | H22C | 154.8° | 174.3° |
| C16 | N1 | C03 | H031 | 57.8° | 58.3° |
| C16 | N1 | C03 | H032 | 178.5° | 178.3° |
| N1 | C16 | H161 | H162 | 119.0° | 120.0° |
| N1 | C16 | C15 | H151 | 174.0° | 179.1° |
| N1 | C16 | C15 | H152 | 65.9° | 60.8° |
| O1 | C7 | C4 | C02 | 179.3° | 180.0° |
| O1 | C7 | C4 | I2 | 1.0° | 0.0° |
| C02 | C4 | C7 | I2 | 179.7° | 179.9° |
| C10 | N2 | C11 | C13 | 134.6° | 124.0° |
| N2 | C10 | C8 | C03 | 178.2° | 177.6° |
| N2 | C10 | C8 | C15 | 117.9° | 119.9° |
| N2 | C10 | C8 | H10 | 120.2° | 120.2° |
| N2 | C10 | C15 | H10 | 119.8° | 120.2° |
| C10 | N2 | C11 | C12 | 155.3° | 165.7° |
| C10 | N2 | C13 | C14 | 94.3° | 56.3° |
| N2 | C10 | C15 | C16 | 173.1° | 177.5° |
| C10 | N2 | C11 | H111 | 84.9° | 45.7° |
| C10 | N2 | C11 | H112 | 35.6° | 74.3° |
| C10 | N2 | C13 | H131 | 145.1° | 63.6° |
| C10 | N2 | C13 | H132 | 26.3° | 176.4° |
| N2 | C10 | C8 | H81C | 61.8° | 62.5° |
| N2 | C10 | C8 | H82C | 58.2° | 57.6° |
| N2 | C10 | C15 | H151 | 67.0° | 62.5° |
| N2 | C10 | C15 | H152 | 53.1° | 57.6° |
| C11 | N2 | C10 | C8 | 159.0° | 180.0° |
| C11 | N2 | C10 | C15 | 39.1° | 60.3° |
| N2 | C11 | C12 | H111 | 119.8° | 120.0° |
| N2 | C11 | C12 | H112 | 119.7° | 120.0° |
| C11 | N2 | C13 | C14 | 133.1° | 67.6° |
| C11 | N2 | C10 | H10 | 80.7° | 59.9° |
| N2 | C11 | H111 | H112 | 120.7° | 120.0° |
| C11 | N2 | C13 | H131 | 12.5° | 172.5° |
| C11 | N2 | C13 | H132 | 106.3° | 52.5° |
| N2 | C11 | C12 | H121 | 180.0° | 56.1° |
| N2 | C11 | C12 | H122 | 60.0° | 176.1° |
| N2 | C11 | C12 | H123 | 60.0° | 63.9° |
| C13 | N2 | C10 | C8 | 69.5° | 56.1° |
| C13 | N2 | C10 | C15 | 170.6° | 175.8° |
| C13 | N2 | C11 | C12 | 20.7° | 70.3° |
| N2 | C13 | C14 | H131 | 120.6° | 119.9° |
| N2 | C13 | C14 | H132 | 120.6° | 120.1° |
| C13 | N2 | C10 | H10 | 50.8° | 64.1° |
| C13 | N2 | C11 | H111 | 140.5° | 169.7° |
| C13 | N2 | C11 | H112 | 99.0° | 49.7° |
| N2 | C13 | H131 | H132 | 118.2° | 120.0° |
| N2 | C13 | C14 | H141 | 180.0° | 63.3° |
| N2 | C13 | C14 | H142 | 60.0° | 56.6° |
| N2 | C13 | C14 | H143 | 60.0° | 176.6° |
| C03 | C8 | C10 | H81C | 120.0° | 119.9° |
| C03 | C8 | C10 | H82C | 120.0° | 120.0° |
| C03 | C8 | C10 | C15 | 60.3° | 57.7° |
| C8 | C03 | H031 | H032 | 121.1° | 119.9° |
| C03 | C8 | C10 | H10 | 61.6° | 62.3° |
| C03 | C8 | H81C | H82C | 120.0° | 120.1° |
| C7 | C4 | C02 | H02 | 179.5° | 180.0° |
| C4 | C7 | O1 | H1 | 0.7° | 90.3° |
| I2 | C4 | C02 | H02 | 0.8° | 0.1° |
| C8 | C10 | C15 | H10 | 122.0° | 119.9° |
| C8 | C10 | C15 | C16 | 54.9° | 57.6° |
| C10 | C8 | C03 | H031 | 57.7° | 60.8° |
| C10 | C8 | C03 | H032 | 178.4° | 179.2° |
| C10 | C8 | H81C | H82C | 120.0° | 120.1° |
| C8 | C10 | C15 | H151 | 174.8° | 177.6° |
| C8 | C10 | C15 | H152 | 65.0° | 62.3° |
| C10 | C15 | C16 | H151 | 119.9° | 120.0° |
| C10 | C15 | C16 | H152 | 119.9° | 119.9° |
| C10 | C15 | C16 | H161 | 174.4° | 179.2° |
| C10 | C15 | C16 | H162 | 66.2° | 60.9° |
| C15 | C10 | C8 | H81C | 179.7° | 177.6° |
| C15 | C10 | C8 | H82C | 59.7° | 62.3° |
| C10 | C15 | H151 | H152 | 120.3° | 120.1° |
| C12 | C11 | H111 | H112 | 120.8° | 120.0° |
| C11 | C12 | H121 | H122 | 120.0° | 120.0° |
| C11 | C12 | H121 | H123 | 120.0° | 120.0° |
| C11 | C12 | H122 | H123 | 120.0° | 120.0° |
| C14 | C13 | H131 | H132 | 118.1° | 120.0° |
| C13 | C14 | H141 | H142 | 120.0° | 120.0° |
| C13 | C14 | H141 | H143 | 120.0° | 120.0° |
| C13 | C14 | H142 | H143 | 120.0° | 120.0° |
| C15 | C16 | H161 | H162 | 119.0° | 119.9° |
| C16 | C15 | C10 | H10 | 67.1° | 62.3° |
| C16 | C15 | H151 | H152 | 120.3° | 120.1° |
| C07 | O01 | C08 | C09 | 171.8° | 60.0° |
| C07 | O01 | C08 | C17 | 54.9° | 180.0° |
| C07 | O01 | C08 | C | 70.8° | 60.0° |
| O01 | C07 | N | H | 13.6° | 0.0° |
| O | C07 | O01 | C08 | 11.9° | 0.0° |
| O | C07 | N | H | 168.9° | 180.0° |
| O01 | C08 | C09 | C17 | 119.4° | 119.9° |
| O01 | C08 | C09 | C | 118.4° | 120.0° |
| O01 | C08 | C17 | C | 124.8° | 120.0° |
| O01 | C08 | C09 | H091 | 180.0° | 60.0° |
| O01 | C08 | C09 | H092 | 60.0° | 180.0° |
| O01 | C08 | C09 | H093 | 60.0° | 60.1° |
| O01 | C08 | C17 | H171 | 180.0° | 60.1° |
| O01 | C08 | C17 | H172 | 60.0° | 180.0° |
| O01 | C08 | C17 | H173 | 60.0° | 60.0° |
| O01 | C08 | C | HC1 | 180.0° | 60.0° |
| O01 | C08 | C | HC2 | 60.0° | 180.0° |
| O01 | C08 | C | HC3 | 60.0° | 60.0° |
| C09 | C08 | C17 | C | 120.3° | 120.1° |
| C08 | C09 | H091 | H092 | 120.0° | 119.9° |
| C08 | C09 | H091 | H093 | 120.0° | 120.0° |
| C08 | C09 | H092 | H093 | 120.0° | 120.0° |
| C09 | C08 | C17 | H171 | 65.1° | 180.0° |
| C09 | C08 | C17 | H172 | 174.9° | 60.0° |
| C09 | C08 | C17 | H173 | 54.9° | 59.9° |
| C09 | C08 | C | HC1 | 65.3° | 59.9° |
| C09 | C08 | C | HC2 | 54.7° | 60.1° |
| C09 | C08 | C | HC3 | 174.7° | 180.0° |
| C17 | C08 | C09 | H091 | 60.6° | 59.9° |
| C17 | C08 | C09 | H092 | 59.4° | 60.1° |
| C17 | C08 | C09 | H093 | 179.4° | 180.0° |
| C08 | C17 | H171 | H172 | 120.0° | 119.9° |
| C08 | C17 | H171 | H173 | 120.0° | 120.1° |
| C08 | C17 | H172 | H173 | 120.0° | 120.0° |
| C17 | C08 | C | HC1 | 54.4° | 180.0° |
| C17 | C08 | C | HC2 | 174.4° | 60.0° |
| C17 | C08 | C | HC3 | 65.6° | 59.9° |
| C | C08 | C09 | H091 | 61.6° | 180.0° |
| C | C08 | C09 | H092 | 178.4° | 60.0° |
| C | C08 | C09 | H093 | 58.4° | 59.9° |
| C | C08 | C17 | H171 | 55.2° | 59.9° |
| C | C08 | C17 | H172 | 64.8° | 60.0° |
| C | C08 | C17 | H173 | 175.2° | 180.0° |
| C08 | C | HC1 | HC2 | 120.0° | 120.0° |
| C08 | C | HC1 | HC3 | 120.0° | 120.0° |
| C08 | C | HC2 | HC3 | 120.0° | 120.0° |
| H061 | C06 | N | H | 20.7° | 120.0° |
| H062 | C06 | N | H | 141.1° | 120.0° |
| H031 | C03 | C8 | H81C | 62.3° | 59.1° |
| H031 | C03 | C8 | H82C | 177.7° | 179.2° |
| H032 | C03 | C8 | H81C | 58.4° | 60.9° |
| H032 | C03 | C8 | H82C | 61.5° | 59.3° |
| H161 | C16 | C15 | H151 | 65.7° | 60.8° |
| H161 | C16 | C15 | H152 | 54.5° | 59.3° |
| H162 | C16 | C15 | H151 | 53.7° | 59.1° |
| H162 | C16 | C15 | H152 | 173.8° | 179.2° |
| H10 | C10 | C8 | H81C | 58.4° | 57.6° |
| H10 | C10 | C8 | H82C | 178.4° | 177.7° |
| H10 | C10 | C15 | H151 | 52.8° | 57.6° |
| H10 | C10 | C15 | H152 | 173.0° | 177.8° |
| H111 | C11 | C12 | H121 | 60.2° | 64.0° |
| H111 | C11 | C12 | H122 | 179.8° | 56.1° |
| H111 | C11 | C12 | H123 | 59.8° | 176.1° |
| H112 | C11 | C12 | H121 | 60.3° | 176.0° |
| H112 | C11 | C12 | H122 | 59.7° | 63.9° |
| H112 | C11 | C12 | H123 | 179.7° | 56.1° |
| H131 | C13 | C14 | H141 | 59.4° | 176.7° |
| H131 | C13 | C14 | H142 | 179.4° | 63.3° |
| H131 | C13 | C14 | H143 | 60.6° | 56.7° |
| H132 | C13 | C14 | H141 | 59.4° | 56.7° |
| H132 | C13 | C14 | H142 | 60.6° | 176.7° |
| H132 | C13 | C14 | H143 | 179.4° | 63.3° |
| H121 | C12 | H122 | H123 | 120.0° | 120.0° |
| H141 | C14 | H142 | H143 | 120.0° | 120.0° |
| H091 | C09 | H092 | H093 | 120.0° | 120.1° |
| H171 | C17 | H172 | H173 | 120.0° | 120.0° |
| HC1 | C | HC2 | HC3 | 120.0° | 120.0° |
