A1IJH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2P | P1 | doub | 1.48Å | 1.50Å | |
| O4P | P1 | sing | 1.61Å | 1.61Å | |
| O4P | C1 | sing | 1.42Å | 1.42Å | |
| P1 | O3P | sing | 1.61Å | 1.51Å | |
| P1 | O1P | sing | 1.61Å | 1.60Å | |
| C2 | C1 | sing | 1.52Å | 1.53Å | |
| C2 | O2 | sing | 1.40Å | 1.42Å | |
| C2 | C3 | sing | 1.54Å | 1.50Å | |
| C14 | N13 | sing | 1.45Å | 1.45Å | |
| C14 | O2 | sing | 1.41Å | 1.42Å | |
| C14 | C5 | sing | 1.50Å | 1.52Å | |
| N13 | C12 | sing | 1.38Å | 1.35Å | |
| C3 | S3 | sing | 1.76Å | 1.69Å | |
| C3 | C4 | doub | 1.30Å | 1.33Å | |
| O28 | C28 | doub | 1.22Å | 1.24Å | |
| S3 | W | sing | 2.41Å | 2.55Å | |
| O1P | MG | sing | 1.84Å | 2.05Å | |
| C4 | C5 | sing | 1.54Å | 1.50Å | |
| C4 | S4 | sing | 1.76Å | 1.67Å | |
| C5 | N6 | sing | 1.46Å | 1.45Å | |
| C12 | N11 | sing | 1.34Å | 1.34Å | |
| C12 | C7 | doub | 1.39Å | 1.47Å | |
| N11 | C10 | doub | 1.31Å | 1.35Å | |
| C28 | N29 | sing | 1.35Å | 1.34Å | |
| C28 | C27 | sing | 1.40Å | 1.48Å | |
| S4 | W | sing | 2.41Å | 2.40Å | |
| N29 | C30 | sing | 1.36Å | 1.35Å | |
| W | S24 | sing | 2.41Å | 2.52Å | |
| W | S23 | sing | 2.41Å | 2.41Å | |
| S24 | C24 | sing | 1.76Å | 1.69Å | |
| N6 | C7 | sing | 1.40Å | 1.34Å | |
| C7 | C8 | sing | 1.40Å | 1.47Å | |
| C10 | N10 | sing | 1.37Å | 1.35Å | |
| C10 | N9 | sing | 1.36Å | 1.34Å | |
| N26 | C27 | sing | 1.41Å | 1.34Å | |
| N26 | C25 | sing | 1.46Å | 1.45Å | |
| MG | O5P | sing | 1.84Å | 2.10Å | |
| C27 | C32 | doub | 1.38Å | 1.47Å | |
| C30 | N30 | sing | 1.37Å | 1.35Å | |
| C30 | N31 | doub | 1.32Å | 1.35Å | |
| C24 | C25 | sing | 1.53Å | 1.50Å | |
| C24 | C23 | doub | 1.31Å | 1.33Å | |
| C25 | C34 | sing | 1.52Å | 1.52Å | |
| N9 | C8 | sing | 1.35Å | 1.34Å | |
| C8 | O8 | doub | 1.22Å | 1.24Å | |
| C32 | N31 | sing | 1.34Å | 1.34Å | |
| C32 | N33 | sing | 1.39Å | 1.35Å | |
| S23 | C23 | sing | 1.77Å | 1.69Å | |
| C23 | C22 | sing | 1.54Å | 1.50Å | |
| O5P | P2 | sing | 1.61Å | 1.60Å | |
| C34 | N33 | sing | 1.46Å | 1.45Å | |
| C34 | O22 | sing | 1.43Å | 1.42Å | |
| O22 | C22 | sing | 1.42Å | 1.42Å | |
| C21 | C22 | sing | 1.54Å | 1.52Å | |
| C21 | O8P | sing | 1.43Å | 1.42Å | |
| O7P | P2 | doub | 1.48Å | 1.51Å | |
| P2 | O8P | sing | 1.60Å | 1.60Å | |
| P2 | O6P | sing | 1.61Å | 1.50Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.11Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| N6 | H6 | sing | 0.97Å | 1.00Å | |
| N9 | H9 | sing | 0.97Å | 1.00Å | |
| N10 | H102 | sing | 0.97Å | 1.00Å | |
| N10 | H101 | sing | 0.97Å | 1.00Å | |
| N13 | H13 | sing | 0.97Å | 1.00Å | |
| C14 | H14 | sing | 1.11Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| N26 | H26 | sing | 0.97Å | 1.00Å | |
| N29 | H29 | sing | 0.97Å | 1.00Å | |
| N30 | H301 | sing | 0.97Å | 1.00Å | |
| N30 | H302 | sing | 0.97Å | 1.00Å | |
| N33 | H33 | sing | 0.97Å | 1.00Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| O3P | H1 | sing | 0.97Å | 0.95Å | |
| O6P | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2P | P1 | O4P | 108.4° | 109.5° |
| O2P | P1 | O3P | 113.0° | 109.4° |
| O2P | P1 | O1P | 108.3° | 109.4° |
| P1 | O4P | C1 | 120.5° | 122.9° |
| O4P | P1 | O3P | 109.7° | 109.5° |
| O4P | P1 | O1P | 108.2° | 109.6° |
| O4P | C1 | C2 | 109.5° | 111.8° |
| O4P | C1 | H12 | 109.5° | 109.1° |
| O4P | C1 | H11 | 109.5° | 109.0° |
| O3P | P1 | O1P | 109.2° | 109.5° |
| P1 | O3P | H1 | 109.5° | 114.0° |
| P1 | O1P | MG | 131.8° | 114.0° |
| C1 | C2 | O2 | 108.9° | 112.7° |
| C1 | C2 | C3 | 110.8° | 110.9° |
| C2 | C1 | H12 | 109.4° | 109.0° |
| C2 | C1 | H11 | 109.4° | 109.0° |
| C1 | C2 | H2 | 108.8° | 107.3° |
| O2 | C2 | C3 | 108.9° | 110.7° |
| C2 | O2 | C14 | 110.0° | 119.5° |
| O2 | C2 | H2 | 110.3° | 107.9° |
| C2 | C3 | S3 | 118.8° | 117.5° |
| C2 | C3 | C4 | 122.1° | 122.5° |
| C3 | C2 | H2 | 109.1° | 107.1° |
| N13 | C14 | O2 | 109.2° | 112.3° |
| N13 | C14 | C5 | 112.0° | 114.2° |
| C14 | N13 | C12 | 120.8° | 123.4° |
| C14 | N13 | H13 | 106.6° | 118.3° |
| N13 | C14 | H14 | 109.3° | 105.8° |
| O2 | C14 | C5 | 108.2° | 111.7° |
| O2 | C14 | H14 | 109.8° | 106.2° |
| C14 | C5 | C4 | 109.0° | 111.9° |
| C14 | C5 | N6 | 110.2° | 113.2° |
| C14 | C5 | H5 | 108.1° | 108.0° |
| C5 | C14 | H14 | 108.4° | 105.9° |
| N13 | C12 | N11 | 121.8° | 120.9° |
| N13 | C12 | C7 | 119.9° | 119.8° |
| C12 | N13 | H13 | 106.6° | 118.3° |
| S3 | C3 | C4 | 119.1° | 119.9° |
| C3 | S3 | W | 110.6° | 103.6° |
| C3 | C4 | C5 | 121.2° | 122.0° |
| C3 | C4 | S4 | 119.9° | 120.5° |
| O28 | C28 | N29 | 121.2° | 120.8° |
| O28 | C28 | C27 | 120.7° | 120.8° |
| S3 | W | S4 | 74.2° | 79.4° |
| S3 | W | S24 | 75.9° | 92.5° |
| S3 | W | S23 | 96.8° | 118.6° |
| O1P | MG | O5P | 176.2° | 109.4° |
| C5 | C4 | S4 | 118.9° | 117.5° |
| C4 | C5 | N6 | 111.8° | 108.4° |
| C4 | C5 | H5 | 108.5° | 107.5° |
| C4 | S4 | W | 115.4° | 103.8° |
| C5 | N6 | C7 | 115.8° | 121.4° |
| N6 | C5 | H5 | 109.1° | 107.6° |
| C5 | N6 | H6 | 107.9° | 119.3° |
| N11 | C12 | C7 | 118.3° | 119.3° |
| C12 | N11 | C10 | 121.4° | 121.4° |
| C12 | C7 | N6 | 119.1° | 119.8° |
| C12 | C7 | C8 | 117.4° | 119.0° |
| N11 | C10 | N10 | 118.1° | 119.2° |
| N11 | C10 | N9 | 122.9° | 121.5° |
| N29 | C28 | C27 | 118.1° | 118.4° |
| C28 | N29 | C30 | 122.3° | 120.3° |
| C28 | N29 | H29 | 118.8° | 119.8° |
| C28 | C27 | N26 | 124.3° | 120.3° |
| C28 | C27 | C32 | 116.9° | 119.0° |
| S4 | W | S24 | 144.3° | 163.4° |
| S4 | W | S23 | 90.2° | 93.1° |
| N29 | C30 | N30 | 119.2° | 119.2° |
| N29 | C30 | N31 | 122.6° | 121.7° |
| C30 | N29 | H29 | 118.9° | 119.9° |
| S24 | W | S23 | 74.4° | 77.9° |
| W | S24 | C24 | 109.1° | 102.5° |
| W | S23 | C23 | 112.0° | 103.1° |
| S24 | C24 | C25 | 119.8° | 119.2° |
| S24 | C24 | C23 | 119.0° | 118.8° |
| N6 | C7 | C8 | 123.5° | 121.2° |
| C7 | N6 | H6 | 107.9° | 119.3° |
| C7 | C8 | N9 | 118.0° | 118.9° |
| C7 | C8 | O8 | 120.5° | 120.6° |
| N10 | C10 | N9 | 118.9° | 119.2° |
| C10 | N10 | H102 | 120.0° | 120.0° |
| C10 | N10 | H101 | 120.0° | 120.0° |
| C10 | N9 | C8 | 122.0° | 119.9° |
| C10 | N9 | H9 | 119.0° | 120.0° |
| C27 | N26 | C25 | 112.9° | 120.4° |
| N26 | C27 | C32 | 118.7° | 120.6° |
| C27 | N26 | H26 | 108.6° | 119.8° |
| N26 | C25 | C24 | 116.1° | 109.6° |
| N26 | C25 | C34 | 108.3° | 111.9° |
| N26 | C25 | H25 | 109.0° | 108.4° |
| C25 | N26 | H26 | 108.6° | 119.8° |
| MG | O5P | P2 | 135.2° | 114.0° |
| C27 | C32 | N31 | 118.7° | 119.8° |
| C27 | C32 | N33 | 119.8° | 119.8° |
| N30 | C30 | N31 | 118.2° | 119.2° |
| C30 | N30 | H301 | 120.0° | 120.0° |
| C30 | N30 | H302 | 120.0° | 120.0° |
| C30 | N31 | C32 | 121.4° | 120.8° |
| C25 | C24 | C23 | 121.2° | 122.0° |
| C24 | C25 | C34 | 106.6° | 110.5° |
| C24 | C25 | H25 | 108.4° | 108.3° |
| C24 | C23 | S23 | 119.5° | 119.6° |
| C24 | C23 | C22 | 122.1° | 122.0° |
| C25 | C34 | N33 | 110.9° | 112.0° |
| C25 | C34 | O22 | 106.8° | 108.6° |
| C34 | C25 | H25 | 108.2° | 108.1° |
| C25 | C34 | H34 | 108.7° | 108.8° |
| N9 | C8 | O8 | 121.4° | 120.5° |
| C8 | N9 | H9 | 119.0° | 120.1° |
| N31 | C32 | N33 | 121.5° | 120.4° |
| C32 | N33 | C34 | 119.8° | 120.7° |
| C32 | N33 | H33 | 106.8° | 119.6° |
| S23 | C23 | C22 | 118.3° | 118.4° |
| C23 | C22 | O22 | 111.2° | 108.9° |
| C23 | C22 | C21 | 108.8° | 108.6° |
| C23 | C22 | H22 | 108.9° | 110.1° |
| O5P | P2 | O7P | 109.1° | 109.4° |
| O5P | P2 | O8P | 107.9° | 109.6° |
| O5P | P2 | O6P | 109.8° | 109.3° |
| N33 | C34 | O22 | 110.8° | 109.6° |
| C34 | N33 | H33 | 106.8° | 119.7° |
| N33 | C34 | H34 | 109.6° | 108.8° |
| C34 | O22 | C22 | 111.6° | 113.3° |
| O22 | C34 | H34 | 110.1° | 109.0° |
| O22 | C22 | C21 | 109.3° | 109.0° |
| O22 | C22 | H22 | 110.0° | 110.6° |
| C22 | C21 | O8P | 109.7° | 108.9° |
| C22 | C21 | H211 | 109.4° | 109.6° |
| C22 | C21 | H212 | 109.4° | 109.6° |
| C21 | C22 | H22 | 108.6° | 109.6° |
| C21 | O8P | P2 | 119.1° | 122.9° |
| O8P | C21 | H211 | 109.4° | 109.5° |
| O8P | C21 | H212 | 109.4° | 109.6° |
| O7P | P2 | O8P | 109.5° | 109.5° |
| O7P | P2 | O6P | 112.0° | 109.5° |
| O8P | P2 | O6P | 108.5° | 109.5° |
| P2 | O6P | H3 | 109.5° | 114.0° |
| H12 | C1 | H11 | 109.5° | 109.0° |
| H102 | N10 | H101 | 120.0° | 120.0° |
| H211 | C21 | H212 | 109.5° | 109.7° |
| H301 | N30 | H302 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2P | P1 | O4P | O3P | 123.8° | 120.0° |
| O2P | P1 | O4P | O1P | 117.2° | 120.0° |
| O2P | P1 | O4P | C1 | 167.2° | 141.0° |
| O2P | P1 | O3P | O1P | 120.6° | 119.9° |
| O2P | P1 | O1P | MG | 156.8° | 33.4° |
| O2P | P1 | O3P | H1 | 0.0° | 60.0° |
| O4P | P1 | O3P | O1P | 118.3° | 120.1° |
| P1 | O4P | C1 | C2 | 139.3° | 131.5° |
| O4P | P1 | O1P | MG | 86.0° | 86.6° |
| P1 | O4P | C1 | H12 | 19.3° | 107.9° |
| P1 | O4P | C1 | H11 | 100.7° | 11.0° |
| O4P | P1 | O3P | H1 | 121.0° | 179.9° |
| C1 | O4P | P1 | O3P | 69.0° | 21.0° |
| C1 | O4P | P1 | O1P | 49.9° | 99.0° |
| O4P | C1 | C2 | H12 | 120.0° | 120.6° |
| O4P | C1 | C2 | H11 | 120.0° | 120.5° |
| O4P | C1 | C2 | O2 | 70.6° | 55.6° |
| O4P | C1 | C2 | C3 | 169.7° | 69.2° |
| O4P | C1 | H12 | H11 | 120.0° | 118.9° |
| O4P | C1 | C2 | H2 | 49.7° | 174.2° |
| O3P | P1 | O1P | MG | 33.3° | 153.3° |
| P1 | O1P | MG | O5P | 4.4° | 83.4° |
| O1P | P1 | O3P | H1 | 120.6° | 60.0° |
| C1 | C2 | O2 | C3 | 120.9° | 124.8° |
| C1 | C2 | O2 | H2 | 119.3° | 118.2° |
| C1 | C2 | C3 | H2 | 119.8° | 116.8° |
| C1 | C2 | O2 | C14 | 178.1° | 82.2° |
| C1 | C2 | C3 | S3 | 36.7° | 68.6° |
| C1 | C2 | C3 | C4 | 143.3° | 112.4° |
| C2 | C1 | H12 | H11 | 120.0° | 118.9° |
| O2 | C2 | C3 | H2 | 120.5° | 117.4° |
| C2 | O2 | C14 | N13 | 164.2° | 72.9° |
| C2 | O2 | C14 | C5 | 73.7° | 57.0° |
| O2 | C2 | C3 | S3 | 156.4° | 165.5° |
| O2 | C2 | C3 | C4 | 23.6° | 13.4° |
| O2 | C2 | C1 | H12 | 49.5° | 176.2° |
| O2 | C2 | C1 | H11 | 169.4° | 64.9° |
| C2 | O2 | C14 | H14 | 44.4° | 172.0° |
| C3 | C2 | O2 | C14 | 57.2° | 42.6° |
| C2 | C3 | S3 | C4 | 180.0° | 179.0° |
| C2 | C3 | S3 | W | 178.7° | 153.7° |
| C2 | C3 | C4 | C5 | 6.0° | 1.2° |
| C2 | C3 | C4 | S4 | 174.1° | 178.5° |
| C3 | C2 | C1 | H12 | 70.3° | 51.5° |
| C3 | C2 | C1 | H11 | 49.7° | 170.3° |
| N13 | C14 | O2 | C5 | 122.1° | 129.9° |
| N13 | C14 | O2 | H14 | 119.8° | 115.2° |
| N13 | C14 | C5 | H14 | 120.7° | 116.0° |
| C14 | N13 | C12 | H13 | 121.6° | 179.9° |
| N13 | C14 | C5 | C4 | 171.0° | 90.5° |
| N13 | C14 | C5 | N6 | 48.0° | 32.4° |
| C14 | N13 | C12 | N11 | 176.3° | 176.6° |
| C14 | N13 | C12 | C7 | 3.8° | 2.9° |
| N13 | C14 | C5 | H5 | 71.2° | 151.4° |
| O2 | C14 | C5 | H14 | 119.0° | 115.1° |
| O2 | C14 | N13 | C12 | 98.8° | 149.4° |
| O2 | C14 | C5 | C4 | 50.7° | 38.3° |
| O2 | C14 | C5 | N6 | 72.4° | 161.2° |
| C14 | O2 | C2 | H2 | 62.6° | 159.5° |
| O2 | C14 | C5 | H5 | 168.4° | 79.8° |
| O2 | C14 | N13 | H13 | 139.6° | 30.7° |
| C5 | C14 | N13 | C12 | 21.0° | 20.8° |
| C14 | C5 | C4 | C3 | 19.0° | 13.7° |
| C14 | C5 | C4 | N6 | 122.0° | 125.5° |
| C14 | C5 | C4 | H5 | 117.5° | 118.4° |
| C14 | C5 | C4 | S4 | 161.1° | 166.0° |
| C14 | C5 | N6 | H5 | 118.6° | 119.2° |
| C14 | C5 | N6 | C7 | 53.3° | 29.8° |
| C14 | C5 | N6 | H6 | 67.6° | 150.2° |
| C5 | C14 | N13 | H13 | 100.6° | 159.3° |
| N13 | C12 | N11 | C7 | 179.9° | 179.5° |
| N13 | C12 | N11 | C10 | 180.0° | 177.7° |
| N13 | C12 | C7 | N6 | 0.6° | 2.2° |
| N13 | C12 | C7 | C8 | 179.7° | 176.7° |
| C12 | N13 | C14 | H14 | 141.1° | 95.2° |
| S3 | C3 | C4 | C5 | 174.0° | 177.8° |
| S3 | C3 | C4 | S4 | 5.9° | 2.5° |
| C3 | S3 | W | S4 | 5.1° | 29.3° |
| C3 | S3 | W | S24 | 155.1° | 136.0° |
| C3 | S3 | W | S23 | 83.1° | 58.4° |
| S3 | C3 | C2 | H2 | 83.1° | 48.1° |
| C4 | C3 | S3 | W | 1.3° | 27.3° |
| C3 | C4 | C5 | S4 | 179.9° | 179.7° |
| C3 | C4 | C5 | N6 | 103.1° | 139.2° |
| C3 | C4 | S4 | W | 10.8° | 23.6° |
| C4 | C3 | C2 | H2 | 96.9° | 130.8° |
| C3 | C4 | C5 | H5 | 136.5° | 104.7° |
| O28 | C28 | N29 | C27 | 179.7° | 180.0° |
| O28 | C28 | N29 | C30 | 179.8° | 178.7° |
| O28 | C28 | C27 | N26 | 1.4° | 0.9° |
| O28 | C28 | C27 | C32 | 179.5° | 179.0° |
| O28 | C28 | N29 | H29 | 0.2° | 1.2° |
| S3 | W | S4 | C4 | 7.9° | 28.4° |
| S3 | W | S4 | S24 | 34.2° | 62.0° |
| S3 | W | S4 | S23 | 97.1° | 118.5° |
| S3 | W | S24 | S23 | 101.4° | 118.7° |
| S3 | W | S24 | C24 | 81.6° | 153.8° |
| S3 | W | S23 | C23 | 53.3° | 119.4° |
| O1P | MG | O5P | P2 | 125.8° | 154.6° |
| C4 | C5 | N6 | H5 | 120.1° | 116.0° |
| C5 | C4 | S4 | W | 169.1° | 156.1° |
| C4 | C5 | N6 | C7 | 174.7° | 95.0° |
| C4 | C5 | N6 | H6 | 53.8° | 85.0° |
| C4 | C5 | C14 | H14 | 68.3° | 153.5° |
| S4 | C4 | C5 | N6 | 76.8° | 40.5° |
| C4 | S4 | W | S24 | 26.4° | 33.6° |
| C4 | S4 | W | S23 | 89.2° | 90.1° |
| S4 | C4 | C5 | H5 | 43.6° | 75.6° |
| C5 | N6 | C7 | C12 | 29.5° | 12.6° |
| C5 | N6 | C7 | H6 | 120.9° | 179.9° |
| C5 | N6 | C7 | C8 | 149.6° | 168.6° |
| N6 | C5 | C14 | H14 | 168.6° | 83.6° |
| N11 | C12 | C7 | N6 | 179.5° | 178.4° |
| N11 | C12 | C7 | C8 | 0.4° | 2.7° |
| C12 | N11 | C10 | N10 | 180.0° | 179.9° |
| C12 | N11 | C10 | N9 | 0.1° | 0.1° |
| N11 | C12 | N13 | H13 | 54.8° | 3.4° |
| C7 | C12 | N11 | C10 | 0.1° | 1.8° |
| C12 | C7 | N6 | C8 | 179.1° | 178.9° |
| C12 | C7 | C8 | N9 | 0.5° | 1.9° |
| C12 | C7 | C8 | O8 | 180.0° | 178.0° |
| C12 | C7 | N6 | H6 | 91.5° | 167.5° |
| C7 | C12 | N13 | H13 | 125.3° | 177.2° |
| N11 | C10 | N10 | N9 | 179.9° | 180.0° |
| N11 | C10 | N9 | C8 | 0.0° | 0.9° |
| N11 | C10 | N9 | H9 | 179.9° | 179.0° |
| N11 | C10 | N10 | H102 | 0.0° | 180.0° |
| N11 | C10 | N10 | H101 | 180.0° | 0.1° |
| C28 | N29 | C30 | H29 | 180.0° | 180.0° |
| N29 | C28 | C27 | N26 | 178.9° | 179.1° |
| N29 | C28 | C27 | C32 | 0.8° | 1.0° |
| C28 | N29 | C30 | N30 | 179.9° | 178.3° |
| C28 | N29 | C30 | N31 | 0.2° | 1.7° |
| C27 | C28 | N29 | C30 | 0.5° | 1.3° |
| C28 | C27 | N26 | C32 | 178.1° | 179.8° |
| C28 | C27 | N26 | C25 | 145.3° | 174.2° |
| C28 | C27 | C32 | N31 | 0.8° | 3.0° |
| C28 | C27 | C32 | N33 | 179.7° | 174.6° |
| C28 | C27 | N26 | H26 | 24.8° | 5.8° |
| C27 | C28 | N29 | H29 | 179.5° | 178.8° |
| S4 | W | S24 | S23 | 67.5° | 58.5° |
| S4 | W | S24 | C24 | 47.7° | 93.5° |
| S4 | W | S23 | C23 | 127.4° | 161.0° |
| N29 | C30 | N30 | N31 | 179.9° | 180.0° |
| N29 | C30 | N31 | C32 | 0.2° | 0.4° |
| N29 | C30 | N30 | H301 | 179.9° | 0.0° |
| N29 | C30 | N30 | H302 | 0.1° | 180.0° |
| W | S24 | C24 | C25 | 164.5° | 147.4° |
| W | S24 | C24 | C23 | 17.8° | 33.6° |
| S24 | W | S23 | C23 | 20.0° | 33.1° |
| S23 | W | S24 | C24 | 19.8° | 35.0° |
| W | S23 | C23 | C24 | 18.3° | 26.2° |
| W | S23 | C23 | C22 | 162.8° | 153.0° |
| S24 | C24 | C25 | N26 | 86.7° | 66.4° |
| S24 | C24 | C25 | C23 | 177.6° | 178.9° |
| S24 | C24 | C25 | C34 | 152.7° | 169.9° |
| S24 | C24 | C23 | S23 | 0.4° | 5.1° |
| S24 | C24 | C23 | C22 | 178.4° | 175.7° |
| S24 | C24 | C25 | H25 | 36.4° | 51.6° |
| N6 | C7 | C8 | N9 | 179.6° | 179.2° |
| N6 | C7 | C8 | O8 | 0.9° | 0.9° |
| C7 | N6 | C5 | H5 | 65.2° | 149.1° |
| C7 | C8 | N9 | C10 | 0.3° | 0.1° |
| C7 | C8 | N9 | O8 | 179.5° | 179.9° |
| C8 | C7 | N6 | H6 | 89.5° | 11.4° |
| C7 | C8 | N9 | H9 | 179.7° | 180.0° |
| N10 | C10 | N9 | C8 | 179.9° | 179.0° |
| N10 | C10 | N9 | H9 | 0.1° | 1.0° |
| C10 | N10 | H102 | H101 | 180.0° | 179.9° |
| C10 | N9 | C8 | H9 | 180.0° | 179.9° |
| C10 | N9 | C8 | O8 | 179.8° | 179.8° |
| N9 | C10 | N10 | H102 | 179.9° | 0.0° |
| N9 | C10 | N10 | H101 | 0.1° | 179.9° |
| C27 | N26 | C25 | H26 | 120.5° | 180.0° |
| C27 | N26 | C25 | C24 | 179.7° | 153.5° |
| C27 | N26 | C25 | C34 | 60.5° | 30.6° |
| N26 | C27 | C32 | N31 | 179.0° | 177.2° |
| N26 | C27 | C32 | N33 | 1.5° | 5.2° |
| C27 | N26 | C25 | H25 | 57.0° | 88.6° |
| C25 | N26 | C27 | C32 | 32.8° | 6.0° |
| N26 | C25 | C24 | C34 | 120.7° | 123.7° |
| N26 | C25 | C24 | H25 | 123.1° | 118.0° |
| N26 | C25 | C24 | C23 | 95.7° | 112.6° |
| N26 | C25 | C34 | H25 | 118.0° | 119.3° |
| N26 | C25 | C34 | N33 | 54.8° | 43.5° |
| N26 | C25 | C34 | O22 | 65.9° | 77.6° |
| N26 | C25 | C34 | H34 | 175.4° | 163.8° |
| MG | O5P | P2 | O7P | 5.2° | 73.9° |
| MG | O5P | P2 | O8P | 113.7° | 166.0° |
| MG | O5P | P2 | O6P | 128.2° | 46.0° |
| C27 | C32 | N31 | C30 | 0.5° | 2.7° |
| C27 | C32 | N31 | N33 | 179.5° | 177.6° |
| C27 | C32 | N33 | C34 | 5.5° | 11.2° |
| C32 | C27 | N26 | H26 | 153.4° | 174.1° |
| C27 | C32 | N33 | H33 | 115.9° | 168.8° |
| N30 | C30 | N31 | C32 | 179.9° | 179.7° |
| N30 | C30 | N29 | H29 | 0.1° | 1.7° |
| C30 | N30 | H301 | H302 | 180.0° | 180.0° |
| C30 | N31 | C32 | N33 | 180.0° | 174.9° |
| N31 | C30 | N29 | H29 | 179.7° | 178.4° |
| N31 | C30 | N30 | H301 | 0.0° | 180.0° |
| N31 | C30 | N30 | H302 | 180.0° | 0.0° |
| C24 | C25 | C34 | H25 | 116.4° | 118.3° |
| C25 | C24 | C23 | S23 | 178.0° | 176.0° |
| C25 | C24 | C23 | C22 | 0.8° | 3.3° |
| C24 | C25 | C34 | N33 | 179.5° | 165.9° |
| C24 | C25 | C34 | O22 | 59.7° | 44.7° |
| C24 | C25 | N26 | H26 | 59.2° | 26.6° |
| C24 | C25 | C34 | H34 | 59.0° | 73.8° |
| C23 | C24 | C25 | C34 | 24.9° | 11.2° |
| C24 | C23 | S23 | C22 | 178.9° | 179.3° |
| C24 | C23 | C22 | O22 | 7.3° | 16.3° |
| C24 | C23 | C22 | C21 | 127.8° | 134.9° |
| C24 | C23 | C22 | H22 | 114.0° | 105.1° |
| C23 | C24 | C25 | H25 | 141.2° | 129.4° |
| C25 | C34 | N33 | C32 | 23.1° | 35.8° |
| C25 | C34 | N33 | O22 | 118.3° | 120.6° |
| C25 | C34 | N33 | H34 | 120.0° | 120.3° |
| C25 | C34 | O22 | H34 | 117.8° | 118.4° |
| C25 | C34 | O22 | C22 | 73.5° | 70.2° |
| C34 | C25 | N26 | H26 | 179.0° | 149.5° |
| C25 | C34 | N33 | H33 | 144.6° | 144.1° |
| O8 | C8 | N9 | H9 | 0.2° | 0.1° |
| N31 | C32 | N33 | C34 | 175.0° | 166.4° |
| N31 | C32 | N33 | H33 | 63.5° | 13.6° |
| C32 | N33 | C34 | H33 | 121.5° | 180.0° |
| C32 | N33 | C34 | O22 | 95.2° | 84.7° |
| C32 | N33 | C34 | H34 | 143.2° | 156.2° |
| S23 | C23 | C22 | O22 | 173.8° | 164.4° |
| S23 | C23 | C22 | C21 | 53.3° | 45.9° |
| S23 | C23 | C22 | H22 | 64.9° | 74.1° |
| C23 | C22 | O22 | C34 | 44.7° | 53.7° |
| C23 | C22 | O22 | C21 | 120.1° | 118.3° |
| C23 | C22 | O22 | H22 | 120.7° | 121.1° |
| C23 | C22 | C21 | H22 | 118.4° | 120.3° |
| C23 | C22 | C21 | O8P | 177.6° | 50.0° |
| C23 | C22 | C21 | H211 | 62.3° | 169.8° |
| C23 | C22 | C21 | H212 | 57.6° | 69.8° |
| O5P | P2 | O8P | C21 | 62.7° | 110.8° |
| O5P | P2 | O7P | O8P | 117.9° | 120.2° |
| O5P | P2 | O7P | O6P | 121.8° | 119.8° |
| O5P | P2 | O8P | O6P | 118.9° | 119.9° |
| O5P | P2 | O6P | H3 | 121.4° | 59.9° |
| N33 | C34 | O22 | H34 | 121.4° | 118.9° |
| N33 | C34 | O22 | C22 | 165.8° | 167.2° |
| N33 | C34 | C25 | H25 | 63.2° | 75.8° |
| C34 | O22 | C22 | C21 | 164.9° | 172.0° |
| C34 | O22 | C22 | H22 | 75.9° | 67.5° |
| O22 | C34 | C25 | H25 | 176.1° | 163.1° |
| O22 | C34 | N33 | H33 | 26.3° | 95.3° |
| O22 | C22 | C21 | H22 | 120.0° | 121.2° |
| O22 | C22 | C21 | O8P | 56.0° | 68.5° |
| O22 | C22 | C21 | H211 | 176.1° | 51.3° |
| O22 | C22 | C21 | H212 | 64.0° | 171.6° |
| C22 | O22 | C34 | H34 | 44.4° | 48.2° |
| C22 | C21 | O8P | H211 | 120.0° | 119.8° |
| C22 | C21 | O8P | H212 | 120.0° | 119.9° |
| C22 | C21 | O8P | P2 | 147.8° | 160.8° |
| C22 | C21 | H211 | H212 | 119.9° | 120.4° |
| C21 | O8P | P2 | O7P | 55.9° | 9.2° |
| C21 | O8P | P2 | O6P | 178.3° | 129.3° |
| O8P | C21 | H211 | H212 | 119.9° | 120.2° |
| O8P | C21 | C22 | H22 | 64.0° | 170.3° |
| O7P | P2 | O8P | O6P | 122.4° | 120.0° |
| O7P | P2 | O6P | H3 | 0.0° | 60.0° |
| P2 | O8P | C21 | H211 | 92.2° | 79.4° |
| P2 | O8P | C21 | H212 | 27.7° | 40.9° |
| O8P | P2 | O6P | H3 | 120.9° | 180.0° |
| H12 | C1 | C2 | H2 | 169.7° | 65.2° |
| H11 | C1 | C2 | H2 | 70.3° | 53.7° |
| H5 | C5 | N6 | H6 | 173.8° | 31.0° |
| H5 | C5 | C14 | H14 | 49.5° | 35.4° |
| H13 | N13 | C14 | H14 | 19.6° | 84.7° |
| H211 | C21 | C22 | H22 | 56.0° | 69.9° |
| H212 | C21 | C22 | H22 | 176.0° | 50.5° |
| H25 | C25 | N26 | H26 | 63.6° | 91.4° |
| H25 | C25 | C34 | H34 | 57.4° | 44.5° |
| H33 | N33 | C34 | H34 | 95.4° | 23.8° |
