A1AZG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N32 | C31 | sing | 1.38Å | 1.37Å | |
| C31 | N30 | doub | 1.33Å | 1.36Å | Aromatic |
| C31 | C33 | sing | 1.41Å | 1.43Å | Aromatic |
| N30 | C29 | sing | 1.32Å | 1.38Å | Aromatic |
| C37 | C35 | sing | 1.53Å | 1.67Å | |
| C35 | C34 | sing | 1.51Å | 1.54Å | |
| C35 | C36 | sing | 1.53Å | 1.54Å | |
| C29 | N28 | doub | 1.32Å | 1.35Å | Aromatic |
| C33 | C34 | sing | 1.41Å | 1.47Å | Aromatic |
| C33 | C27 | doub | 1.41Å | 1.42Å | Aromatic |
| C34 | N38 | doub | 1.30Å | 1.37Å | Aromatic |
| C27 | N28 | sing | 1.33Å | 1.36Å | Aromatic |
| C27 | N26 | sing | 1.36Å | 1.38Å | Aromatic |
| N38 | N26 | sing | 1.40Å | 1.38Å | Aromatic |
| N26 | C03 | sing | 1.46Å | 1.47Å | |
| O04 | C03 | sing | 1.44Å | 1.40Å | |
| O04 | C05 | sing | 1.44Å | 1.43Å | |
| O24 | S10 | doub | 1.42Å | 1.44Å | |
| C03 | C02 | sing | 1.55Å | 1.62Å | |
| C08 | O09 | sing | 1.43Å | 1.36Å | |
| C08 | C05 | sing | 1.53Å | 1.48Å | |
| O09 | S10 | sing | 1.52Å | 1.72Å | |
| C05 | C06 | sing | 1.54Å | 1.63Å | |
| O25 | S10 | doub | 1.42Å | 1.40Å | |
| S10 | N11 | sing | 1.66Å | 1.62Å | |
| C02 | C06 | sing | 1.55Å | 1.50Å | |
| C02 | O01 | sing | 1.43Å | 1.41Å | |
| C06 | O07 | sing | 1.43Å | 1.41Å | |
| N11 | C12 | sing | 1.35Å | 1.41Å | |
| O23 | C12 | doub | 1.21Å | 1.26Å | |
| C12 | C13 | sing | 1.51Å | 1.55Å | |
| C15 | C13 | sing | 1.53Å | 1.65Å | |
| C15 | C16 | sing | 1.51Å | 1.44Å | |
| C13 | N14 | sing | 1.47Å | 1.46Å | |
| C16 | C21 | doub | 1.38Å | 1.37Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.41Å | Aromatic |
| C21 | C20 | sing | 1.38Å | 1.42Å | Aromatic |
| C17 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C19 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.37Å | Aromatic |
| C19 | O22 | sing | 1.36Å | 1.31Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C36 | H362 | sing | 1.09Å | 1.10Å | |
| C36 | H363 | sing | 1.09Å | 1.10Å | |
| C36 | H361 | sing | 1.09Å | 1.10Å | |
| C37 | H373 | sing | 1.09Å | 1.10Å | |
| C37 | H372 | sing | 1.09Å | 1.10Å | |
| C37 | H371 | sing | 1.09Å | 1.10Å | |
| N11 | H111 | sing | 0.97Å | 1.00Å | |
| N14 | H142 | sing | 1.01Å | 1.00Å | |
| N14 | H141 | sing | 1.01Å | 1.00Å | |
| N32 | H321 | sing | 0.97Å | 1.00Å | |
| N32 | H322 | sing | 0.97Å | 1.00Å | |
| O01 | H011 | sing | 0.97Å | 0.95Å | |
| O07 | H071 | sing | 0.97Å | 0.95Å | |
| O22 | H221 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N32 | C31 | N30 | 118.0° | 120.8° |
| N32 | C31 | C33 | 124.5° | 120.8° |
| C31 | N32 | H321 | 109.5° | 120.0° |
| C31 | N32 | H322 | 109.4° | 120.0° |
| N30 | C31 | C33 | 117.5° | 118.4° |
| C31 | N30 | C29 | 120.8° | 121.2° |
| C31 | C33 | C34 | 138.2° | 134.7° |
| C31 | C33 | C27 | 116.6° | 118.3° |
| N30 | C29 | N28 | 125.6° | 122.6° |
| N30 | C29 | H291 | 117.2° | 118.7° |
| C37 | C35 | C34 | 112.3° | 109.5° |
| C37 | C35 | C36 | 106.5° | 109.5° |
| C37 | C35 | H351 | 106.2° | 109.5° |
| C35 | C37 | H373 | 109.5° | 109.4° |
| C35 | C37 | H372 | 109.4° | 109.5° |
| C35 | C37 | H371 | 109.5° | 109.5° |
| C34 | C35 | C36 | 116.1° | 109.5° |
| C35 | C34 | C33 | 126.7° | 125.8° |
| C35 | C34 | N38 | 125.3° | 125.8° |
| C34 | C35 | H351 | 107.6° | 109.5° |
| C36 | C35 | H351 | 107.6° | 109.5° |
| C35 | C36 | H362 | 109.5° | 109.5° |
| C35 | C36 | H363 | 109.5° | 109.5° |
| C35 | C36 | H361 | 109.5° | 109.5° |
| C29 | N28 | C27 | 113.1° | 120.7° |
| N28 | C29 | H291 | 117.2° | 118.7° |
| C34 | C33 | C27 | 105.2° | 107.1° |
| C33 | C34 | N38 | 107.9° | 108.4° |
| C33 | C27 | N28 | 126.3° | 118.8° |
| C33 | C27 | N26 | 108.0° | 106.6° |
| C34 | N38 | N26 | 108.7° | 109.7° |
| N28 | C27 | N26 | 125.7° | 134.6° |
| C27 | N26 | N38 | 110.2° | 108.2° |
| C27 | N26 | C03 | 126.3° | 125.9° |
| N38 | N26 | C03 | 123.5° | 125.9° |
| N26 | C03 | O04 | 109.9° | 110.8° |
| N26 | C03 | C02 | 111.6° | 110.6° |
| N26 | C03 | H031 | 110.7° | 110.6° |
| C03 | O04 | C05 | 109.6° | 107.0° |
| O04 | C03 | C02 | 104.0° | 103.5° |
| O04 | C03 | H031 | 111.8° | 110.6° |
| O04 | C05 | C08 | 107.5° | 110.0° |
| O04 | C05 | C06 | 107.9° | 107.3° |
| O04 | C05 | H051 | 110.3° | 109.9° |
| O24 | S10 | O09 | 105.3° | 106.4° |
| O24 | S10 | O25 | 119.2° | 123.1° |
| O24 | S10 | N11 | 112.7° | 106.4° |
| C03 | C02 | C06 | 101.2° | 102.1° |
| C03 | C02 | O01 | 113.4° | 110.9° |
| C03 | C02 | H021 | 109.4° | 110.9° |
| C02 | C03 | H031 | 108.7° | 110.6° |
| O09 | C08 | C05 | 116.2° | 109.5° |
| C08 | O09 | S10 | 115.7° | 114.0° |
| O09 | C08 | H082 | 107.8° | 109.5° |
| O09 | C08 | H081 | 107.8° | 109.5° |
| C08 | C05 | C06 | 113.6° | 109.9° |
| C08 | C05 | H051 | 109.6° | 109.9° |
| C05 | C08 | H082 | 107.8° | 109.5° |
| C05 | C08 | H081 | 107.7° | 109.4° |
| O09 | S10 | O25 | 100.6° | 106.4° |
| O09 | S10 | N11 | 100.0° | 107.2° |
| C05 | C06 | C02 | 98.7° | 104.2° |
| C05 | C06 | O07 | 109.0° | 110.5° |
| C06 | C05 | H051 | 107.8° | 109.8° |
| C05 | C06 | H061 | 111.2° | 110.5° |
| O25 | S10 | N11 | 115.5° | 106.4° |
| S10 | N11 | C12 | 131.4° | 120.0° |
| S10 | N11 | H111 | 114.3° | 120.0° |
| C06 | C02 | O01 | 108.6° | 110.9° |
| C02 | C06 | O07 | 108.7° | 110.5° |
| C06 | C02 | H021 | 111.0° | 110.9° |
| C02 | C06 | H061 | 113.1° | 110.5° |
| O01 | C02 | H021 | 112.5° | 110.8° |
| C02 | O01 | H011 | 109.5° | 113.9° |
| O07 | C06 | H061 | 114.8° | 110.6° |
| C06 | O07 | H071 | 109.5° | 114.0° |
| N11 | C12 | O23 | 115.2° | 120.0° |
| N11 | C12 | C13 | 121.8° | 120.0° |
| C12 | N11 | H111 | 114.3° | 120.0° |
| O23 | C12 | C13 | 123.0° | 120.0° |
| C12 | C13 | C15 | 109.5° | 109.5° |
| C12 | C13 | N14 | 109.1° | 109.5° |
| C12 | C13 | H131 | 106.1° | 109.5° |
| C13 | C15 | C16 | 107.9° | 109.5° |
| C15 | C13 | N14 | 119.0° | 109.5° |
| C15 | C13 | H131 | 105.1° | 109.5° |
| C13 | C15 | H151 | 109.9° | 109.5° |
| C13 | C15 | H152 | 109.9° | 109.4° |
| C15 | C16 | C21 | 119.3° | 119.9° |
| C15 | C16 | C17 | 124.2° | 119.9° |
| C16 | C15 | H151 | 109.9° | 109.5° |
| C16 | C15 | H152 | 109.8° | 109.5° |
| N14 | C13 | H131 | 107.2° | 109.4° |
| C13 | N14 | H142 | 109.5° | 111.0° |
| C13 | N14 | H141 | 109.4° | 111.0° |
| C21 | C16 | C17 | 116.5° | 120.1° |
| C16 | C21 | C20 | 122.2° | 120.1° |
| C16 | C21 | H211 | 118.9° | 120.0° |
| C16 | C17 | C18 | 122.2° | 120.1° |
| C16 | C17 | H171 | 118.9° | 120.0° |
| C21 | C20 | C19 | 119.3° | 119.9° |
| C21 | C20 | H201 | 120.4° | 120.1° |
| C20 | C21 | H211 | 118.9° | 119.9° |
| C17 | C18 | C19 | 120.8° | 119.9° |
| C18 | C17 | H171 | 118.9° | 120.0° |
| C17 | C18 | H181 | 119.6° | 120.0° |
| C20 | C19 | C18 | 119.0° | 119.9° |
| C20 | C19 | O22 | 120.3° | 120.0° |
| C19 | C20 | H201 | 120.3° | 120.0° |
| C18 | C19 | O22 | 120.7° | 120.0° |
| C19 | C18 | H181 | 119.6° | 120.1° |
| C19 | O22 | H221 | 109.5° | 114.0° |
| H082 | C08 | H081 | 109.4° | 109.4° |
| H151 | C15 | H152 | 109.5° | 109.5° |
| H362 | C36 | H363 | 109.5° | 109.5° |
| H362 | C36 | H361 | 109.4° | 109.4° |
| H363 | C36 | H361 | 109.5° | 109.4° |
| H373 | C37 | H372 | 109.4° | 109.4° |
| H373 | C37 | H371 | 109.5° | 109.5° |
| H372 | C37 | H371 | 109.5° | 109.5° |
| H142 | N14 | H141 | 109.5° | 111.0° |
| H321 | N32 | H322 | 109.5° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N32 | C31 | N30 | C33 | 177.7° | 179.2° |
| N32 | C31 | N30 | C29 | 179.7° | 180.0° |
| N32 | C31 | C33 | C34 | 1.7° | 0.3° |
| N32 | C31 | C33 | C27 | 180.0° | 179.7° |
| C31 | N32 | H321 | H322 | 120.0° | 179.9° |
| C31 | N30 | C29 | N28 | 2.8° | 0.6° |
| N30 | C31 | C33 | C34 | 179.2° | 179.5° |
| N30 | C31 | C33 | C27 | 2.5° | 0.5° |
| C31 | N30 | C29 | H291 | 177.2° | 179.5° |
| N30 | C31 | N32 | H321 | 0.0° | 10.0° |
| N30 | C31 | N32 | H322 | 120.0° | 170.1° |
| C33 | C31 | N30 | C29 | 2.6° | 0.8° |
| C31 | C33 | C34 | C35 | 0.4° | 0.1° |
| C31 | C33 | C34 | C27 | 178.4° | 180.0° |
| C31 | C33 | C34 | N38 | 178.4° | 180.0° |
| C31 | C33 | C27 | N28 | 2.7° | 0.0° |
| C31 | C33 | C27 | N26 | 179.0° | 179.8° |
| C33 | C31 | N32 | H321 | 177.5° | 170.8° |
| C33 | C31 | N32 | H322 | 62.5° | 9.1° |
| N30 | C29 | N28 | H291 | 180.0° | 179.9° |
| N30 | C29 | N28 | C27 | 2.6° | 0.0° |
| C37 | C35 | C34 | C36 | 123.0° | 120.0° |
| C37 | C35 | C34 | H351 | 116.5° | 120.0° |
| C37 | C35 | C36 | H351 | 113.5° | 120.0° |
| C37 | C35 | C34 | C33 | 132.3° | 139.1° |
| C37 | C35 | C34 | N38 | 45.3° | 40.9° |
| C37 | C35 | C36 | H362 | 180.0° | 60.0° |
| C37 | C35 | C36 | H363 | 60.0° | 60.0° |
| C37 | C35 | C36 | H361 | 60.0° | 180.0° |
| C35 | C37 | H373 | H372 | 120.0° | 119.9° |
| C35 | C37 | H373 | H371 | 120.0° | 120.0° |
| C35 | C37 | H372 | H371 | 120.0° | 120.1° |
| C34 | C35 | C36 | H351 | 120.5° | 120.0° |
| C35 | C34 | C33 | N38 | 178.0° | 179.9° |
| C35 | C34 | C33 | C27 | 178.0° | 179.9° |
| C35 | C34 | N38 | N26 | 178.2° | 179.8° |
| C34 | C35 | C36 | H362 | 54.0° | 60.0° |
| C34 | C35 | C36 | H363 | 174.1° | 180.0° |
| C34 | C35 | C36 | H361 | 65.9° | 60.0° |
| C34 | C35 | C37 | H373 | 180.0° | 60.0° |
| C34 | C35 | C37 | H372 | 60.0° | 180.0° |
| C34 | C35 | C37 | H371 | 60.0° | 60.0° |
| C36 | C35 | C34 | C33 | 104.7° | 100.9° |
| C36 | C35 | C34 | N38 | 77.6° | 79.0° |
| C35 | C36 | H362 | H363 | 120.0° | 120.0° |
| C35 | C36 | H362 | H361 | 120.0° | 120.0° |
| C35 | C36 | H363 | H361 | 120.0° | 120.1° |
| C36 | C35 | C37 | H373 | 51.8° | 180.0° |
| C36 | C35 | C37 | H372 | 171.8° | 60.1° |
| C36 | C35 | C37 | H371 | 68.2° | 60.0° |
| C29 | N28 | C27 | C33 | 2.6° | 0.3° |
| C29 | N28 | C27 | N26 | 179.4° | 179.9° |
| C34 | C33 | C27 | N28 | 178.5° | 179.9° |
| C34 | C33 | C27 | N26 | 0.2° | 0.2° |
| C33 | C34 | N38 | N26 | 0.2° | 0.2° |
| C33 | C34 | C35 | H351 | 15.8° | 19.1° |
| C27 | C33 | C34 | N38 | 0.0° | 0.0° |
| C33 | C27 | N28 | N26 | 178.0° | 179.6° |
| C33 | C27 | N26 | N38 | 0.4° | 0.4° |
| C33 | C27 | N26 | C03 | 177.4° | 179.8° |
| C34 | N38 | N26 | C27 | 0.4° | 0.4° |
| C34 | N38 | N26 | C03 | 177.4° | 179.8° |
| N38 | C34 | C35 | H351 | 161.8° | 161.0° |
| N28 | C27 | N26 | N38 | 178.7° | 180.0° |
| N28 | C27 | N26 | C03 | 0.9° | 0.1° |
| C27 | N28 | C29 | H291 | 177.4° | 180.0° |
| C27 | N26 | N38 | C03 | 177.8° | 179.9° |
| C27 | N26 | C03 | O04 | 124.6° | 140.8° |
| C27 | N26 | C03 | C02 | 120.6° | 105.0° |
| C27 | N26 | C03 | H031 | 0.6° | 17.9° |
| N38 | N26 | C03 | O04 | 58.0° | 39.0° |
| N38 | N26 | C03 | C02 | 56.9° | 75.1° |
| N38 | N26 | C03 | H031 | 178.0° | 162.0° |
| N26 | C03 | O04 | C02 | 119.6° | 118.6° |
| N26 | C03 | O04 | H031 | 123.3° | 122.9° |
| N26 | C03 | O04 | C05 | 146.3° | 158.6° |
| N26 | C03 | C02 | H031 | 122.3° | 122.9° |
| N26 | C03 | C02 | C06 | 161.3° | 155.7° |
| N26 | C03 | C02 | O01 | 82.6° | 86.1° |
| N26 | C03 | C02 | H021 | 44.0° | 37.5° |
| O04 | C03 | C02 | H031 | 119.2° | 118.5° |
| C03 | O04 | C05 | C08 | 125.1° | 146.0° |
| C03 | O04 | C05 | C06 | 2.1° | 26.5° |
| O04 | C03 | C02 | C06 | 42.8° | 37.0° |
| O04 | C03 | C02 | O01 | 159.0° | 155.2° |
| O04 | C03 | C02 | H021 | 74.5° | 81.2° |
| C03 | O04 | C05 | H051 | 115.4° | 92.9° |
| C05 | O04 | C03 | C02 | 26.7° | 40.0° |
| O04 | C05 | C08 | O09 | 60.1° | 67.1° |
| O04 | C05 | C08 | C06 | 119.4° | 117.9° |
| O04 | C05 | C08 | H051 | 120.0° | 121.1° |
| O04 | C05 | C06 | H051 | 119.2° | 119.4° |
| O04 | C05 | C06 | C02 | 25.0° | 2.0° |
| O04 | C05 | C06 | O07 | 88.4° | 120.7° |
| C05 | O04 | C03 | H031 | 90.3° | 78.4° |
| O04 | C05 | C06 | H061 | 144.0° | 116.6° |
| O04 | C05 | C08 | H082 | 178.9° | 172.9° |
| O04 | C05 | C08 | H081 | 60.9° | 52.9° |
| O24 | S10 | O09 | C08 | 52.2° | 38.6° |
| O24 | S10 | O09 | O25 | 124.4° | 132.9° |
| O24 | S10 | O09 | N11 | 117.1° | 113.6° |
| O24 | S10 | O25 | N11 | 139.1° | 123.0° |
| O24 | S10 | N11 | C12 | 172.9° | 178.6° |
| O24 | S10 | N11 | H111 | 7.1° | 1.4° |
| C03 | C02 | C06 | C05 | 38.0° | 20.9° |
| C03 | C02 | C06 | O01 | 119.7° | 118.2° |
| C03 | C02 | C06 | H021 | 116.1° | 118.2° |
| C03 | C02 | O01 | H021 | 124.9° | 123.6° |
| C03 | C02 | C06 | O07 | 75.6° | 97.8° |
| C03 | C02 | C06 | H061 | 155.6° | 139.5° |
| C03 | C02 | O01 | H011 | 180.0° | 174.2° |
| O09 | C08 | C05 | H082 | 121.0° | 120.0° |
| O09 | C08 | C05 | H081 | 121.0° | 120.0° |
| O09 | C08 | C05 | C06 | 59.3° | 175.0° |
| C08 | O09 | S10 | O25 | 176.6° | 171.5° |
| C08 | O09 | S10 | N11 | 64.9° | 75.0° |
| O09 | C08 | C05 | H051 | 180.0° | 54.0° |
| O09 | C08 | H082 | H081 | 116.9° | 120.0° |
| C05 | C08 | O09 | S10 | 167.7° | 180.0° |
| C08 | C05 | C06 | H051 | 121.7° | 121.0° |
| C08 | C05 | C06 | C02 | 94.1° | 121.6° |
| C08 | C05 | C06 | O07 | 152.5° | 119.7° |
| C08 | C05 | C06 | H061 | 24.9° | 3.0° |
| C05 | C08 | H082 | H081 | 116.9° | 119.9° |
| O09 | S10 | O25 | N11 | 106.5° | 114.1° |
| O09 | S10 | N11 | C12 | 75.7° | 65.0° |
| S10 | O09 | C08 | H082 | 46.7° | 60.0° |
| S10 | O09 | C08 | H081 | 71.3° | 60.0° |
| O09 | S10 | N11 | H111 | 104.3° | 115.0° |
| C05 | C06 | C02 | O07 | 113.6° | 118.7° |
| C05 | C06 | C02 | H061 | 117.6° | 118.6° |
| C05 | C06 | C02 | O01 | 157.7° | 139.1° |
| C05 | C06 | O07 | H061 | 125.6° | 122.6° |
| C05 | C06 | C02 | H021 | 78.1° | 97.3° |
| C06 | C05 | C08 | H082 | 61.7° | 54.9° |
| C06 | C05 | C08 | H081 | 179.7° | 65.0° |
| C05 | C06 | O07 | H071 | 180.0° | 176.2° |
| O25 | S10 | N11 | C12 | 31.2° | 48.5° |
| O25 | S10 | N11 | H111 | 148.8° | 131.5° |
| S10 | N11 | C12 | H111 | 180.0° | 180.0° |
| S10 | N11 | C12 | O23 | 5.3° | 0.0° |
| S10 | N11 | C12 | C13 | 175.2° | 180.0° |
| C06 | C02 | O01 | H021 | 123.4° | 123.6° |
| C02 | C06 | O07 | H061 | 127.8° | 122.6° |
| C06 | C02 | C03 | H031 | 76.4° | 81.5° |
| C02 | C06 | C05 | H051 | 144.2° | 117.4° |
| C06 | C02 | O01 | H011 | 68.3° | 61.4° |
| C02 | C06 | O07 | H071 | 73.4° | 61.5° |
| O01 | C02 | C06 | O07 | 44.1° | 20.4° |
| O01 | C02 | C03 | H031 | 39.8° | 36.8° |
| O01 | C02 | C06 | H061 | 84.7° | 102.3° |
| O07 | C06 | C02 | H021 | 168.3° | 144.0° |
| O07 | C06 | C05 | H051 | 30.8° | 1.3° |
| N11 | C12 | O23 | C13 | 179.5° | 180.0° |
| N11 | C12 | C13 | C15 | 11.6° | 80.0° |
| N11 | C12 | C13 | N14 | 143.5° | 160.0° |
| N11 | C12 | C13 | H131 | 101.3° | 40.1° |
| O23 | C12 | C13 | C15 | 167.8° | 100.0° |
| O23 | C12 | C13 | N14 | 36.0° | 20.0° |
| O23 | C12 | C13 | H131 | 79.2° | 140.0° |
| O23 | C12 | N11 | H111 | 174.7° | 180.0° |
| C12 | C13 | C15 | N14 | 126.5° | 120.0° |
| C12 | C13 | C15 | H131 | 113.6° | 120.0° |
| C12 | C13 | C15 | C16 | 161.3° | 175.0° |
| C12 | C13 | N14 | H131 | 114.5° | 120.0° |
| C12 | C13 | C15 | H151 | 79.0° | 65.0° |
| C12 | C13 | C15 | H152 | 41.5° | 55.0° |
| C13 | C12 | N11 | H111 | 4.8° | 0.0° |
| C12 | C13 | N14 | H142 | 180.0° | 60.0° |
| C12 | C13 | N14 | H141 | 60.0° | 176.0° |
| C13 | C15 | C16 | H151 | 119.8° | 120.0° |
| C13 | C15 | C16 | H152 | 119.7° | 120.0° |
| C15 | C13 | N14 | H131 | 118.8° | 120.0° |
| C13 | C15 | C16 | C21 | 67.7° | 90.0° |
| C13 | C15 | C16 | C17 | 110.1° | 89.7° |
| C13 | C15 | H151 | H152 | 120.7° | 119.9° |
| C15 | C13 | N14 | H142 | 53.4° | 60.0° |
| C15 | C13 | N14 | H141 | 173.3° | 64.0° |
| C16 | C15 | C13 | N14 | 72.3° | 65.0° |
| C15 | C16 | C21 | C17 | 177.9° | 179.7° |
| C15 | C16 | C21 | C20 | 178.1° | 179.7° |
| C15 | C16 | C17 | C18 | 176.9° | 180.0° |
| C16 | C15 | C13 | H131 | 47.7° | 55.0° |
| C16 | C15 | H151 | H152 | 120.7° | 120.0° |
| C15 | C16 | C17 | H171 | 3.1° | 0.0° |
| C15 | C16 | C21 | H211 | 2.0° | 0.0° |
| N14 | C13 | C15 | H151 | 47.5° | 55.0° |
| N14 | C13 | C15 | H152 | 168.0° | 175.0° |
| C13 | N14 | H142 | H141 | 120.0° | 124.0° |
| C16 | C21 | C20 | H211 | 180.0° | 179.7° |
| C21 | C16 | C17 | C18 | 0.9° | 0.3° |
| C16 | C21 | C20 | C19 | 0.0° | 0.5° |
| C21 | C16 | C15 | H151 | 172.5° | 30.0° |
| C21 | C16 | C15 | H152 | 52.1° | 150.0° |
| C21 | C16 | C17 | H171 | 179.1° | 179.7° |
| C16 | C21 | C20 | H201 | 180.0° | 179.7° |
| C17 | C16 | C21 | C20 | 0.1° | 0.6° |
| C16 | C17 | C18 | H171 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 2.1° | 0.1° |
| C17 | C16 | C15 | H151 | 9.7° | 150.3° |
| C17 | C16 | C15 | H152 | 130.2° | 30.2° |
| C16 | C17 | C18 | H181 | 177.9° | 180.0° |
| C17 | C16 | C21 | H211 | 179.9° | 179.7° |
| C21 | C20 | C19 | H201 | 180.0° | 179.8° |
| C21 | C20 | C19 | C18 | 1.1° | 0.3° |
| C21 | C20 | C19 | O22 | 179.1° | 179.8° |
| C17 | C18 | C19 | C20 | 2.2° | 0.0° |
| C17 | C18 | C19 | H181 | 180.0° | 180.0° |
| C17 | C18 | C19 | O22 | 178.1° | 180.0° |
| C20 | C19 | C18 | O22 | 179.7° | 180.0° |
| C20 | C19 | C18 | H181 | 177.9° | 180.0° |
| C19 | C20 | C21 | H211 | 180.0° | 179.8° |
| C20 | C19 | O22 | H221 | 180.0° | 90.0° |
| C19 | C18 | C17 | H171 | 177.9° | 180.0° |
| C18 | C19 | C20 | H201 | 178.9° | 179.9° |
| C18 | C19 | O22 | H221 | 0.3° | 90.0° |
| O22 | C19 | C18 | H181 | 1.9° | 0.0° |
| O22 | C19 | C20 | H201 | 0.9° | 0.0° |
| H021 | C02 | C03 | H031 | 166.3° | 160.4° |
| H021 | C02 | C06 | H061 | 39.5° | 21.3° |
| H021 | C02 | O01 | H011 | 55.1° | 62.2° |
| H051 | C05 | C06 | H061 | 96.8° | 124.0° |
| H051 | C05 | C08 | H082 | 59.0° | 66.0° |
| H051 | C05 | C08 | H081 | 59.1° | 174.0° |
| H061 | C06 | O07 | H071 | 54.4° | 61.2° |
| H131 | C13 | C15 | H151 | 167.4° | 175.0° |
| H131 | C13 | C15 | H152 | 72.1° | 65.0° |
| H131 | C13 | N14 | H142 | 65.5° | 180.0° |
| H131 | C13 | N14 | H141 | 54.5° | 56.0° |
| H171 | C17 | C18 | H181 | 2.1° | 0.0° |
| H201 | C20 | C21 | H211 | 0.0° | 0.0° |
| H351 | C35 | C36 | H362 | 66.5° | 180.0° |
| H351 | C35 | C36 | H363 | 53.6° | 60.0° |
| H351 | C35 | C36 | H361 | 173.6° | 60.0° |
| H351 | C35 | C37 | H373 | 62.7° | 60.0° |
| H351 | C35 | C37 | H372 | 57.3° | 60.0° |
| H351 | C35 | C37 | H371 | 177.3° | 180.0° |
| H362 | C36 | H363 | H361 | 119.9° | 119.9° |
| H373 | C37 | H372 | H371 | 120.0° | 120.0° |
