151
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C2 | doub | 1.22Å | 1.24Å | |
| C2 | N1 | sing | 1.35Å | 1.38Å | |
| C2 | C4 | sing | 1.47Å | 1.37Å | |
| N1 | C26 | sing | 1.48Å | 1.45Å | |
| N1 | C8 | sing | 1.47Å | 1.44Å | |
| C26 | C28 | sing | 1.55Å | 1.55Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C28 | C29 | sing | 1.55Å | 1.52Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C29 | N2 | sing | 1.46Å | 1.42Å | |
| C29 | C8 | sing | 1.54Å | 1.55Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| N2 | S1 | sing | 1.66Å | 1.71Å | |
| N2 | H2 | sing | 0.97Å | 1.00Å | |
| S1 | C3 | sing | 1.81Å | 1.77Å | |
| S1 | O1 | doub | 1.42Å | 1.50Å | |
| S1 | O2 | doub | 1.42Å | 1.53Å | |
| C3 | H3C1 | sing | 1.09Å | 1.10Å | |
| C3 | H3C2 | sing | 1.09Å | 1.10Å | |
| C3 | H3C3 | sing | 1.09Å | 1.10Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | C27 | sing | 1.53Å | 1.56Å | |
| C7 | C30 | sing | 1.51Å | 1.55Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C27 | C1 | sing | 1.53Å | 1.53Å | |
| C27 | C17 | sing | 1.53Å | 1.54Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C1 | H1C1 | sing | 1.09Å | 1.10Å | |
| C1 | H1C2 | sing | 1.09Å | 1.10Å | |
| C1 | H1C3 | 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 | |
| C30 | O5 | doub | 1.21Å | 1.26Å | |
| C30 | O51 | sing | 1.34Å | 1.54Å | |
| C4 | N3 | sing | 1.36Å | 1.43Å | Aromatic |
| C4 | C6 | doub | 1.36Å | 1.40Å | Aromatic |
| N3 | C5 | doub | 1.30Å | 1.42Å | Aromatic |
| C5 | O4 | sing | 1.34Å | 1.38Å | Aromatic |
| C5 | C9 | sing | 1.51Å | 1.49Å | |
| O4 | C6 | sing | 1.34Å | 1.37Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C9 | N4 | sing | 1.47Å | 1.45Å | |
| C9 | H9C1 | sing | 1.09Å | 1.10Å | |
| C9 | H9C2 | sing | 1.09Å | 1.10Å | |
| N4 | C11 | sing | 1.48Å | 1.47Å | |
| N4 | C12 | sing | 1.48Å | 1.48Å | |
| C11 | C13 | sing | 1.54Å | 1.52Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.55Å | 1.52Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | C12 | sing | 1.55Å | 1.54Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| O51 | HO' | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C2 | N1 | 123.8° | 120.0° |
| O3 | C2 | C4 | 117.7° | 120.0° |
| N1 | C2 | C4 | 117.7° | 120.0° |
| C2 | N1 | C26 | 123.5° | 125.7° |
| C2 | N1 | C8 | 123.5° | 125.8° |
| C2 | C4 | N3 | 127.1° | 126.4° |
| C2 | C4 | C6 | 120.9° | 126.5° |
| C26 | N1 | C8 | 112.7° | 108.5° |
| N1 | C26 | C28 | 104.5° | 104.8° |
| N1 | C26 | H261 | 112.2° | 110.3° |
| N1 | C26 | H262 | 111.2° | 110.5° |
| N1 | C8 | C29 | 96.7° | 107.4° |
| N1 | C8 | C7 | 115.0° | 109.9° |
| N1 | C8 | H8 | 114.5° | 109.9° |
| C28 | C26 | H261 | 112.2° | 110.4° |
| C28 | C26 | H262 | 111.2° | 110.4° |
| C26 | C28 | C29 | 100.4° | 101.6° |
| C26 | C28 | H281 | 114.5° | 111.0° |
| C26 | C28 | H282 | 112.6° | 111.0° |
| H261 | C26 | H262 | 105.7° | 110.4° |
| C29 | C28 | H281 | 114.5° | 111.0° |
| C29 | C28 | H282 | 112.6° | 111.0° |
| C28 | C29 | N2 | 104.7° | 110.9° |
| C28 | C29 | C8 | 104.3° | 102.9° |
| C28 | C29 | H29 | 115.7° | 110.7° |
| H281 | C28 | H282 | 102.7° | 110.9° |
| N2 | C29 | C8 | 109.5° | 110.8° |
| N2 | C29 | H29 | 111.0° | 110.6° |
| C29 | N2 | S1 | 117.6° | 120.0° |
| C29 | N2 | H2 | 106.9° | 120.0° |
| C8 | C29 | H29 | 111.3° | 110.7° |
| C29 | C8 | C7 | 109.9° | 109.9° |
| C29 | C8 | H8 | 119.2° | 109.8° |
| S1 | N2 | H2 | 106.8° | 120.0° |
| N2 | S1 | C3 | 114.9° | 103.1° |
| N2 | S1 | O1 | 100.3° | 102.8° |
| N2 | S1 | O2 | 105.1° | 102.8° |
| C3 | S1 | O1 | 117.6° | 111.6° |
| C3 | S1 | O2 | 108.1° | 111.6° |
| S1 | C3 | H3C1 | 109.4° | 109.4° |
| S1 | C3 | H3C2 | 109.4° | 109.5° |
| S1 | C3 | H3C3 | 109.5° | 109.5° |
| O1 | S1 | O2 | 110.0° | 122.1° |
| H3C1 | C3 | H3C2 | 109.5° | 109.5° |
| H3C1 | C3 | H3C3 | 109.4° | 109.5° |
| H3C2 | C3 | H3C3 | 109.5° | 109.5° |
| C7 | C8 | H8 | 102.3° | 109.8° |
| C8 | C7 | C27 | 116.9° | 109.5° |
| C8 | C7 | C30 | 108.3° | 109.5° |
| C8 | C7 | H7 | 105.1° | 109.5° |
| C27 | C7 | C30 | 109.4° | 109.5° |
| C27 | C7 | H7 | 104.0° | 109.5° |
| C7 | C27 | C1 | 107.4° | 109.5° |
| C7 | C27 | C17 | 109.2° | 109.5° |
| C7 | C27 | H27 | 112.3° | 109.5° |
| C30 | C7 | H7 | 113.2° | 109.5° |
| C7 | C30 | O5 | 128.9° | 120.0° |
| C7 | C30 | O51 | 106.7° | 120.0° |
| C1 | C27 | C17 | 113.0° | 109.5° |
| C1 | C27 | H27 | 108.5° | 109.4° |
| C27 | C1 | H1C1 | 109.4° | 109.5° |
| C27 | C1 | H1C2 | 109.4° | 109.4° |
| C27 | C1 | H1C3 | 109.5° | 109.4° |
| C17 | C27 | H27 | 106.6° | 109.5° |
| C27 | C17 | H171 | 109.4° | 109.5° |
| C27 | C17 | H172 | 109.5° | 109.5° |
| C27 | C17 | H173 | 109.5° | 109.5° |
| H1C1 | C1 | H1C2 | 109.5° | 109.5° |
| H1C1 | C1 | H1C3 | 109.5° | 109.5° |
| H1C2 | C1 | H1C3 | 109.4° | 109.5° |
| H171 | C17 | H172 | 109.5° | 109.4° |
| H171 | C17 | H173 | 109.5° | 109.5° |
| H172 | C17 | H173 | 109.5° | 109.5° |
| O5 | C30 | O51 | 119.4° | 120.1° |
| C30 | O51 | HO' | 109.5° | 120.0° |
| N3 | C4 | C6 | 111.7° | 107.1° |
| C4 | N3 | C5 | 99.1° | 108.4° |
| C4 | C6 | O4 | 108.8° | 106.9° |
| C4 | C6 | H6 | 125.6° | 126.5° |
| N3 | C5 | O4 | 115.4° | 109.2° |
| N3 | C5 | C9 | 121.9° | 125.4° |
| O4 | C5 | C9 | 122.6° | 125.4° |
| C5 | O4 | C6 | 104.9° | 108.3° |
| C5 | C9 | N4 | 114.7° | 109.5° |
| C5 | C9 | H9C1 | 106.6° | 109.5° |
| C5 | C9 | H9C2 | 107.8° | 109.4° |
| O4 | C6 | H6 | 125.6° | 126.6° |
| N4 | C9 | H9C1 | 106.5° | 109.5° |
| N4 | C9 | H9C2 | 107.8° | 109.5° |
| C9 | N4 | C11 | 116.1° | 106.7° |
| C9 | N4 | C12 | 110.2° | 106.7° |
| H9C1 | C9 | H9C2 | 113.7° | 109.5° |
| C11 | N4 | C12 | 106.4° | 108.5° |
| N4 | C11 | C13 | 105.0° | 107.2° |
| N4 | C11 | H111 | 112.0° | 109.9° |
| N4 | C11 | H112 | 111.0° | 109.9° |
| N4 | C12 | C14 | 105.3° | 104.8° |
| N4 | C12 | H121 | 111.8° | 110.4° |
| N4 | C12 | H122 | 110.9° | 110.3° |
| C13 | C11 | H111 | 111.9° | 109.9° |
| C13 | C11 | H112 | 111.0° | 109.9° |
| C11 | C13 | C14 | 98.3° | 103.0° |
| C11 | C13 | H131 | 115.7° | 110.7° |
| C11 | C13 | H132 | 113.4° | 110.7° |
| H111 | C11 | H112 | 106.0° | 110.0° |
| C14 | C13 | H131 | 115.6° | 110.7° |
| C14 | C13 | H132 | 113.4° | 110.8° |
| C13 | C14 | C12 | 101.8° | 101.6° |
| C13 | C14 | H141 | 113.7° | 111.0° |
| C13 | C14 | H142 | 112.1° | 111.0° |
| H131 | C13 | H132 | 101.2° | 110.7° |
| C12 | C14 | H141 | 113.7° | 111.0° |
| C12 | C14 | H142 | 112.1° | 111.0° |
| C14 | C12 | H121 | 111.8° | 110.4° |
| C14 | C12 | H122 | 110.9° | 110.4° |
| H141 | C14 | H142 | 103.8° | 110.9° |
| H121 | C12 | H122 | 106.3° | 110.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C2 | N1 | C4 | 169.5° | 180.0° |
| O3 | C2 | N1 | C26 | 156.5° | 178.0° |
| O3 | C2 | N1 | C8 | 16.3° | 2.2° |
| O3 | C2 | C4 | N3 | 153.0° | 179.7° |
| O3 | C2 | C4 | C6 | 34.1° | 0.0° |
| C2 | N1 | C26 | C8 | 173.4° | 179.9° |
| C2 | N1 | C26 | C28 | 160.2° | 155.9° |
| C2 | N1 | C26 | H261 | 38.4° | 37.1° |
| C2 | N1 | C26 | H262 | 79.8° | 85.2° |
| C2 | N1 | C8 | C29 | 137.3° | 179.0° |
| C2 | N1 | C8 | C7 | 107.1° | 61.6° |
| C2 | N1 | C8 | H8 | 10.9° | 59.5° |
| N1 | C2 | C4 | N3 | 36.9° | 0.3° |
| N1 | C2 | C4 | C6 | 136.1° | 180.0° |
| C4 | C2 | N1 | C26 | 13.0° | 2.0° |
| C4 | C2 | N1 | C8 | 174.3° | 177.8° |
| C2 | C4 | N3 | C6 | 173.5° | 179.8° |
| C2 | C4 | N3 | C5 | 175.1° | 179.8° |
| C2 | C4 | C6 | O4 | 176.9° | 180.0° |
| C2 | C4 | C6 | H6 | 3.1° | 0.0° |
| N1 | C26 | C28 | H261 | 121.8° | 118.7° |
| N1 | C26 | C28 | H262 | 120.0° | 119.0° |
| N1 | C26 | H261 | H262 | 121.3° | 122.4° |
| N1 | C26 | C28 | C29 | 16.7° | 37.1° |
| N1 | C26 | C28 | H281 | 139.9° | 81.0° |
| N1 | C26 | C28 | H282 | 103.3° | 155.2° |
| C26 | N1 | C8 | C29 | 36.1° | 1.2° |
| C26 | N1 | C8 | C7 | 79.5° | 118.3° |
| C26 | N1 | C8 | H8 | 162.5° | 120.7° |
| C8 | N1 | C26 | C28 | 13.2° | 24.3° |
| C8 | N1 | C26 | H261 | 135.1° | 143.0° |
| C8 | N1 | C26 | H262 | 106.8° | 94.6° |
| N1 | C8 | C29 | C28 | 45.7° | 22.1° |
| N1 | C8 | C29 | N2 | 65.8° | 140.7° |
| N1 | C8 | C29 | C7 | 119.6° | 119.5° |
| N1 | C8 | C29 | H8 | 122.9° | 119.6° |
| N1 | C8 | C29 | H29 | 171.1° | 96.2° |
| N1 | C8 | C7 | H8 | 124.7° | 121.1° |
| N1 | C8 | C7 | C27 | 69.8° | 179.9° |
| N1 | C8 | C7 | C30 | 166.1° | 60.1° |
| N1 | C8 | C7 | H7 | 44.8° | 59.9° |
| C28 | C26 | H261 | H262 | 121.4° | 122.3° |
| C26 | C28 | C29 | H281 | 123.1° | 118.1° |
| C26 | C28 | C29 | H282 | 120.0° | 118.1° |
| C26 | C28 | H281 | H282 | 122.4° | 123.9° |
| C26 | C28 | C29 | N2 | 76.1° | 154.0° |
| C26 | C28 | C29 | C8 | 39.0° | 35.5° |
| C26 | C28 | C29 | H29 | 161.5° | 82.8° |
| H261 | C26 | C28 | C29 | 105.1° | 155.8° |
| H261 | C26 | C28 | H281 | 18.0° | 37.7° |
| H261 | C26 | C28 | H282 | 134.9° | 86.1° |
| H262 | C26 | C28 | C29 | 136.7° | 81.9° |
| H262 | C26 | C28 | H281 | 100.1° | 160.1° |
| H262 | C26 | C28 | H282 | 16.7° | 36.3° |
| C29 | C28 | H281 | H282 | 122.4° | 123.9° |
| C28 | C29 | N2 | C8 | 111.3° | 113.6° |
| C28 | C29 | N2 | H29 | 125.4° | 123.3° |
| C28 | C29 | C8 | H29 | 125.4° | 118.3° |
| C28 | C29 | N2 | S1 | 158.4° | 99.7° |
| C28 | C29 | N2 | H2 | 38.5° | 80.3° |
| C28 | C29 | C8 | C7 | 73.9° | 141.6° |
| C28 | C29 | C8 | H8 | 168.6° | 97.5° |
| H281 | C28 | C29 | N2 | 47.1° | 35.9° |
| H281 | C28 | C29 | C8 | 162.1° | 82.6° |
| H281 | C28 | C29 | H29 | 75.3° | 159.1° |
| H282 | C28 | C29 | N2 | 163.9° | 88.0° |
| H282 | C28 | C29 | C8 | 81.0° | 153.6° |
| H282 | C28 | C29 | H29 | 41.5° | 35.2° |
| N2 | C29 | C8 | H29 | 123.0° | 123.1° |
| C29 | N2 | S1 | H2 | 120.0° | 180.0° |
| C29 | N2 | S1 | C3 | 16.8° | 63.2° |
| C29 | N2 | S1 | O1 | 144.0° | 179.4° |
| C29 | N2 | S1 | O2 | 101.8° | 52.9° |
| N2 | C29 | C8 | C7 | 174.6° | 99.8° |
| N2 | C29 | C8 | H8 | 57.1° | 21.1° |
| C8 | C29 | N2 | S1 | 90.2° | 146.7° |
| C8 | C29 | N2 | H2 | 149.8° | 33.3° |
| C29 | C8 | C7 | H8 | 127.6° | 120.9° |
| C29 | C8 | C7 | C27 | 177.6° | 62.1° |
| C29 | C8 | C7 | C30 | 58.4° | 57.9° |
| C29 | C8 | C7 | H7 | 62.9° | 177.9° |
| H29 | C29 | N2 | S1 | 33.0° | 23.6° |
| H29 | C29 | N2 | H2 | 87.0° | 156.4° |
| H29 | C29 | C8 | C7 | 51.5° | 23.3° |
| H29 | C29 | C8 | H8 | 66.0° | 144.2° |
| N2 | S1 | C3 | O1 | 117.8° | 109.7° |
| N2 | S1 | C3 | O2 | 117.0° | 109.7° |
| N2 | S1 | O1 | O2 | 110.4° | 114.3° |
| N2 | S1 | C3 | H3C1 | 72.1° | 60.0° |
| N2 | S1 | C3 | H3C2 | 47.9° | 180.0° |
| N2 | S1 | C3 | H3C3 | 168.0° | 60.0° |
| H2 | N2 | S1 | C3 | 103.2° | 116.8° |
| H2 | N2 | S1 | O1 | 24.0° | 0.6° |
| H2 | N2 | S1 | O2 | 138.2° | 127.1° |
| C3 | S1 | O1 | O2 | 124.3° | 135.7° |
| S1 | C3 | H3C1 | H3C2 | 120.0° | 120.0° |
| S1 | C3 | H3C1 | H3C3 | 120.0° | 120.0° |
| S1 | C3 | H3C2 | H3C3 | 120.1° | 120.0° |
| O1 | S1 | C3 | H3C1 | 45.7° | 49.7° |
| O1 | S1 | C3 | H3C2 | 165.7° | 70.3° |
| O1 | S1 | C3 | H3C3 | 74.2° | 169.7° |
| O2 | S1 | C3 | H3C1 | 171.0° | 169.7° |
| O2 | S1 | C3 | H3C2 | 69.0° | 70.3° |
| O2 | S1 | C3 | H3C3 | 51.0° | 49.7° |
| H3C1 | C3 | H3C2 | H3C3 | 120.0° | 120.1° |
| C8 | C7 | C27 | C30 | 123.5° | 120.0° |
| C8 | C7 | C27 | H7 | 115.3° | 120.0° |
| C8 | C7 | C30 | H7 | 116.2° | 120.0° |
| C8 | C7 | C27 | C1 | 59.1° | 57.9° |
| C8 | C7 | C27 | C17 | 178.0° | 177.9° |
| C8 | C7 | C27 | H27 | 60.0° | 62.1° |
| C8 | C7 | C30 | O5 | 68.2° | 93.3° |
| C8 | C7 | C30 | O51 | 137.7° | 86.7° |
| H8 | C8 | C7 | C27 | 54.9° | 58.8° |
| H8 | C8 | C7 | C30 | 69.2° | 178.8° |
| H8 | C8 | C7 | H7 | 169.5° | 61.2° |
| C27 | C7 | C30 | H7 | 115.4° | 120.0° |
| C7 | C27 | C1 | C17 | 120.4° | 120.0° |
| C7 | C27 | C1 | H27 | 121.6° | 120.0° |
| C7 | C27 | C17 | H27 | 121.6° | 120.0° |
| C7 | C27 | C1 | H1C1 | 45.8° | 53.8° |
| C7 | C27 | C1 | H1C2 | 165.8° | 173.7° |
| C7 | C27 | C1 | H1C3 | 74.2° | 66.3° |
| C7 | C27 | C17 | H171 | 21.2° | 60.0° |
| C7 | C27 | C17 | H172 | 141.2° | 60.0° |
| C7 | C27 | C17 | H173 | 98.8° | 180.0° |
| C27 | C7 | C30 | O5 | 60.3° | 26.7° |
| C27 | C7 | C30 | O51 | 93.9° | 153.3° |
| C30 | C7 | C27 | C1 | 64.3° | 177.9° |
| C30 | C7 | C27 | C17 | 58.5° | 62.1° |
| C30 | C7 | C27 | H27 | 176.5° | 57.9° |
| C7 | C30 | O5 | O51 | 151.4° | 180.0° |
| C7 | C30 | O51 | HO' | 157.1° | 179.9° |
| H7 | C7 | C27 | C1 | 174.4° | 62.1° |
| H7 | C7 | C27 | C17 | 62.8° | 57.9° |
| H7 | C7 | C27 | H27 | 55.3° | 177.9° |
| H7 | C7 | C30 | O5 | 175.7° | 146.7° |
| H7 | C7 | C30 | O51 | 21.5° | 33.3° |
| C1 | C27 | C17 | H27 | 119.1° | 120.0° |
| C27 | C1 | H1C1 | H1C2 | 120.0° | 120.0° |
| C27 | C1 | H1C1 | H1C3 | 120.0° | 120.0° |
| C27 | C1 | H1C2 | H1C3 | 120.0° | 119.9° |
| C1 | C27 | C17 | H171 | 140.6° | 60.0° |
| C1 | C27 | C17 | H172 | 99.4° | 180.0° |
| C1 | C27 | C17 | H173 | 20.6° | 60.0° |
| C17 | C27 | C1 | H1C1 | 74.6° | 66.3° |
| C17 | C27 | C1 | H1C2 | 45.4° | 53.7° |
| C17 | C27 | C1 | H1C3 | 165.4° | 173.7° |
| C27 | C17 | H171 | H172 | 120.0° | 120.0° |
| C27 | C17 | H171 | H173 | 120.0° | 120.1° |
| C27 | C17 | H172 | H173 | 120.0° | 120.0° |
| H27 | C27 | C1 | H1C1 | 167.4° | 173.8° |
| H27 | C27 | C1 | H1C2 | 72.6° | 66.3° |
| H27 | C27 | C1 | H1C3 | 47.4° | 53.7° |
| H27 | C27 | C17 | H171 | 100.3° | 180.0° |
| H27 | C27 | C17 | H172 | 19.6° | 60.1° |
| H27 | C27 | C17 | H173 | 139.7° | 60.0° |
| H1C1 | C1 | H1C2 | H1C3 | 120.0° | 120.1° |
| H171 | C17 | H172 | H173 | 120.0° | 120.0° |
| O5 | C30 | O51 | HO' | 0.0° | 0.1° |
| C4 | N3 | C5 | O4 | 0.2° | 0.4° |
| C4 | N3 | C5 | C9 | 178.7° | 179.9° |
| N3 | C4 | C6 | O4 | 3.0° | 0.2° |
| N3 | C4 | C6 | H6 | 177.0° | 179.8° |
| C6 | C4 | N3 | C5 | 1.6° | 0.4° |
| C4 | C6 | O4 | C5 | 2.8° | 0.0° |
| C4 | C6 | O4 | H6 | 180.0° | 180.0° |
| N3 | C5 | O4 | C9 | 178.5° | 179.7° |
| N3 | C5 | O4 | C6 | 1.9° | 0.2° |
| N3 | C5 | C9 | N4 | 86.4° | 90.3° |
| N3 | C5 | C9 | H9C1 | 155.9° | 149.6° |
| N3 | C5 | C9 | H9C2 | 33.6° | 29.7° |
| C5 | O4 | C6 | H6 | 177.1° | 180.0° |
| O4 | C5 | C9 | N4 | 95.2° | 90.0° |
| O4 | C5 | C9 | H9C1 | 22.5° | 30.1° |
| O4 | C5 | C9 | H9C2 | 144.8° | 150.0° |
| C9 | C5 | O4 | C6 | 179.6° | 180.0° |
| C5 | C9 | N4 | H9C1 | 117.7° | 120.0° |
| C5 | C9 | N4 | H9C2 | 120.0° | 119.9° |
| C5 | C9 | H9C1 | H9C2 | 118.5° | 120.0° |
| C5 | C9 | N4 | C11 | 81.8° | 170.0° |
| C5 | C9 | N4 | C12 | 157.1° | 74.1° |
| N4 | C9 | H9C1 | H9C2 | 118.5° | 120.0° |
| C9 | N4 | C11 | C12 | 123.1° | 114.7° |
| C9 | N4 | C11 | C13 | 97.0° | 115.7° |
| C9 | N4 | C11 | H111 | 24.7° | 124.9° |
| C9 | N4 | C11 | H112 | 143.0° | 3.8° |
| C9 | N4 | C12 | C14 | 130.1° | 138.7° |
| C9 | N4 | C12 | H121 | 108.3° | 19.8° |
| C9 | N4 | C12 | H122 | 10.1° | 102.4° |
| H9C1 | C9 | N4 | C11 | 160.5° | 50.0° |
| H9C1 | C9 | N4 | C12 | 39.5° | 165.8° |
| H9C2 | C9 | N4 | C11 | 38.2° | 70.0° |
| H9C2 | C9 | N4 | C12 | 82.9° | 45.8° |
| N4 | C11 | C13 | H111 | 121.7° | 119.4° |
| N4 | C11 | C13 | H112 | 120.0° | 119.4° |
| N4 | C11 | H111 | H112 | 121.2° | 121.1° |
| N4 | C11 | C13 | C14 | 44.8° | 22.3° |
| N4 | C11 | C13 | H131 | 78.9° | 140.7° |
| N4 | C11 | C13 | H132 | 164.8° | 96.1° |
| C11 | N4 | C12 | C14 | 3.4° | 24.1° |
| C11 | N4 | C12 | H121 | 125.0° | 94.8° |
| C11 | N4 | C12 | H122 | 116.6° | 143.0° |
| C12 | N4 | C11 | C13 | 26.1° | 1.0° |
| C12 | N4 | C11 | H111 | 147.8° | 120.4° |
| C12 | N4 | C11 | H112 | 93.9° | 118.4° |
| N4 | C12 | C14 | C13 | 31.5° | 37.1° |
| N4 | C12 | C14 | H121 | 121.6° | 118.9° |
| N4 | C12 | C14 | H122 | 120.0° | 118.8° |
| N4 | C12 | C14 | H141 | 154.2° | 81.0° |
| N4 | C12 | C14 | H142 | 88.5° | 155.2° |
| N4 | C12 | H121 | H122 | 121.2° | 122.2° |
| C13 | C11 | H111 | H112 | 121.2° | 121.1° |
| C11 | C13 | C14 | H131 | 123.7° | 118.4° |
| C11 | C13 | C14 | H132 | 120.0° | 118.4° |
| C11 | C13 | H131 | H132 | 123.0° | 123.2° |
| C11 | C13 | C14 | C12 | 45.5° | 35.7° |
| C11 | C13 | C14 | H141 | 168.2° | 82.4° |
| C11 | C13 | C14 | H142 | 74.5° | 153.7° |
| H111 | C11 | C13 | C14 | 166.5° | 97.1° |
| H111 | C11 | C13 | H131 | 42.8° | 21.3° |
| H111 | C11 | C13 | H132 | 73.5° | 144.5° |
| H112 | C11 | C13 | C14 | 75.2° | 141.7° |
| H112 | C11 | C13 | H131 | 161.1° | 99.9° |
| H112 | C11 | C13 | H132 | 44.8° | 23.3° |
| C14 | C13 | H131 | H132 | 122.9° | 123.2° |
| C13 | C14 | C12 | H141 | 122.7° | 118.1° |
| C13 | C14 | C12 | H142 | 120.0° | 118.0° |
| C13 | C14 | H141 | H142 | 122.1° | 123.9° |
| C13 | C14 | C12 | H121 | 153.1° | 81.8° |
| C13 | C14 | C12 | H122 | 88.5° | 155.9° |
| H131 | C13 | C14 | C12 | 78.3° | 154.1° |
| H131 | C13 | C14 | H141 | 44.4° | 35.9° |
| H131 | C13 | C14 | H142 | 161.7° | 87.9° |
| H132 | C13 | C14 | C12 | 165.5° | 82.7° |
| H132 | C13 | C14 | H141 | 71.8° | 159.2° |
| H132 | C13 | C14 | H142 | 45.5° | 35.3° |
| C12 | C14 | H141 | H142 | 122.0° | 123.9° |
| C14 | C12 | H121 | H122 | 121.1° | 122.3° |
| H141 | C14 | C12 | H121 | 84.2° | 160.1° |
| H141 | C14 | C12 | H122 | 34.2° | 37.8° |
| H142 | C14 | C12 | H121 | 33.1° | 36.3° |
| H142 | C14 | C12 | H122 | 151.5° | 86.0° |
