P5H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | S15 | sing | 1.81Å | 1.81Å | |
| C10 | C06 | sing | 1.51Å | 1.52Å | |
| N07 | C06 | doub | 1.31Å | 1.32Å | |
| N07 | C08 | sing | 1.34Å | 1.31Å | |
| C06 | C05 | sing | 1.41Å | 1.38Å | |
| O09 | C08 | doub | 1.21Å | 1.39Å | |
| C08 | C03 | sing | 1.52Å | 1.40Å | |
| S15 | O16 | doub | 1.42Å | 1.47Å | |
| S15 | N14 | sing | 1.66Å | 1.70Å | |
| S15 | O17 | doub | 1.42Å | 1.47Å | |
| C05 | C04 | doub | 1.34Å | 1.38Å | |
| N14 | C13 | sing | 1.46Å | 1.44Å | |
| C03 | C04 | sing | 1.52Å | 1.39Å | |
| C03 | C02 | sing | 1.51Å | 1.53Å | |
| N11 | C02 | sing | 1.35Å | 1.45Å | |
| N11 | C12 | sing | 1.47Å | 1.45Å | |
| C02 | O01 | doub | 1.21Å | 1.19Å | |
| C13 | C12 | sing | 1.53Å | 1.52Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C03 | H6 | sing | 1.09Å | 1.10Å | |
| C04 | H7 | sing | 1.08Å | 1.08Å | |
| C05 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C18 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| N11 | H14 | sing | 0.97Å | 1.00Å | |
| N14 | H15 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C18 | S15 | O16 | 112.2° | 110.5° |
| C18 | S15 | N14 | 109.6° | 104.4° |
| C18 | S15 | O17 | 112.0° | 110.5° |
| S15 | C18 | H11 | 109.5° | 109.5° |
| S15 | C18 | H12 | 109.5° | 109.4° |
| S15 | C18 | H13 | 109.5° | 109.4° |
| C10 | C06 | N07 | 119.7° | 117.9° |
| C10 | C06 | C05 | 120.0° | 117.9° |
| C06 | C10 | H1 | 109.5° | 109.5° |
| C06 | C10 | H2 | 109.4° | 109.5° |
| C06 | C10 | H3 | 109.5° | 109.5° |
| C06 | N07 | C08 | 121.6° | 122.5° |
| N07 | C06 | C05 | 120.2° | 124.2° |
| N07 | C08 | O09 | 116.8° | 120.9° |
| N07 | C08 | C03 | 120.9° | 118.3° |
| C06 | C05 | C04 | 120.5° | 121.1° |
| C06 | C05 | H8 | 119.8° | 119.4° |
| O09 | C08 | C03 | 122.3° | 120.8° |
| C08 | C03 | C04 | 119.3° | 116.6° |
| C08 | C03 | C02 | 122.7° | 108.1° |
| C08 | C03 | H6 | 90.9° | 108.0° |
| O16 | S15 | N14 | 110.3° | 104.3° |
| O16 | S15 | O17 | 101.2° | 121.1° |
| N14 | S15 | O17 | 111.3° | 104.3° |
| S15 | N14 | C13 | 116.9° | 120.0° |
| S15 | N14 | H15 | 107.6° | 120.0° |
| C05 | C04 | C03 | 117.4° | 117.3° |
| C05 | C04 | H7 | 121.3° | 121.3° |
| C04 | C05 | H8 | 119.7° | 119.5° |
| N14 | C13 | C12 | 109.6° | 109.5° |
| N14 | C13 | H4 | 109.4° | 109.5° |
| N14 | C13 | H5 | 109.4° | 109.5° |
| C13 | N14 | H15 | 107.6° | 120.0° |
| C04 | C03 | C02 | 117.9° | 108.0° |
| C04 | C03 | H6 | 90.9° | 108.0° |
| C03 | C04 | H7 | 121.3° | 121.3° |
| C03 | C02 | N11 | 118.9° | 120.0° |
| C03 | C02 | O01 | 120.5° | 120.1° |
| C02 | C03 | H6 | 90.8° | 107.9° |
| C02 | N11 | C12 | 121.7° | 120.0° |
| N11 | C02 | O01 | 120.6° | 120.0° |
| C02 | N11 | H14 | 119.2° | 120.0° |
| N11 | C12 | C13 | 112.9° | 109.5° |
| N11 | C12 | H9 | 108.6° | 109.5° |
| N11 | C12 | H10 | 108.6° | 109.4° |
| C12 | N11 | H14 | 119.1° | 120.0° |
| C12 | C13 | H4 | 109.4° | 109.5° |
| C12 | C13 | H5 | 109.4° | 109.4° |
| C13 | C12 | H9 | 108.6° | 109.5° |
| C13 | C12 | H10 | 108.6° | 109.5° |
| H1 | C10 | H2 | 109.5° | 109.5° |
| H1 | C10 | H3 | 109.5° | 109.5° |
| H2 | C10 | H3 | 109.5° | 109.4° |
| H4 | C13 | H5 | 109.5° | 109.4° |
| H9 | C12 | H10 | 109.5° | 109.4° |
| H11 | C18 | H12 | 109.5° | 109.5° |
| H11 | C18 | H13 | 109.5° | 109.5° |
| H12 | C18 | H13 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C18 | S15 | O16 | N14 | 122.5° | 111.7° |
| C18 | S15 | O16 | O17 | 119.5° | 131.5° |
| C18 | S15 | N14 | O17 | 124.4° | 116.0° |
| C18 | S15 | N14 | C13 | 164.2° | 65.0° |
| S15 | C18 | H11 | H12 | 120.0° | 120.0° |
| S15 | C18 | H11 | H13 | 120.0° | 120.0° |
| S15 | C18 | H12 | H13 | 120.0° | 119.9° |
| C18 | S15 | N14 | H15 | 43.1° | 115.0° |
| C10 | C06 | N07 | C05 | 180.0° | 179.9° |
| C10 | C06 | N07 | C08 | 179.6° | 180.0° |
| C10 | C06 | C05 | C04 | 179.5° | 180.0° |
| C06 | C10 | H1 | H2 | 120.0° | 120.1° |
| C06 | C10 | H1 | H3 | 120.0° | 120.0° |
| C06 | C10 | H2 | H3 | 120.0° | 120.0° |
| C10 | C06 | C05 | H8 | 0.5° | 0.0° |
| C06 | N07 | C08 | O09 | 180.0° | 180.0° |
| C06 | N07 | C08 | C03 | 0.9° | 0.0° |
| N07 | C06 | C05 | C04 | 0.5° | 0.0° |
| N07 | C06 | C10 | H1 | 0.0° | 90.1° |
| N07 | C06 | C10 | H2 | 120.0° | 30.0° |
| N07 | C06 | C10 | H3 | 120.0° | 149.9° |
| N07 | C06 | C05 | H8 | 179.5° | 180.0° |
| C08 | N07 | C06 | C05 | 0.4° | 0.0° |
| N07 | C08 | O09 | C03 | 179.1° | 180.0° |
| N07 | C08 | C03 | C04 | 1.5° | 0.0° |
| N07 | C08 | C03 | C02 | 178.5° | 121.8° |
| N07 | C08 | C03 | H6 | 90.0° | 121.8° |
| C06 | C05 | C04 | H8 | 180.0° | 180.0° |
| C06 | C05 | C04 | C03 | 1.1° | 0.0° |
| C05 | C06 | C10 | H1 | 180.0° | 90.0° |
| C05 | C06 | C10 | H2 | 60.0° | 150.0° |
| C05 | C06 | C10 | H3 | 60.0° | 30.0° |
| C06 | C05 | C04 | H7 | 178.9° | 180.0° |
| O09 | C08 | C03 | C04 | 179.5° | 180.0° |
| O09 | C08 | C03 | C02 | 2.4° | 58.2° |
| O09 | C08 | C03 | H6 | 89.0° | 58.2° |
| C08 | C03 | C04 | C05 | 1.6° | 0.0° |
| C08 | C03 | C04 | C02 | 177.2° | 121.8° |
| C08 | C03 | C04 | H6 | 91.5° | 121.8° |
| C08 | C03 | C02 | H6 | 91.6° | 116.5° |
| C08 | C03 | C02 | N11 | 0.4° | 53.1° |
| C08 | C03 | C02 | O01 | 176.9° | 127.0° |
| C08 | C03 | C04 | H7 | 178.4° | 180.0° |
| O16 | S15 | N14 | O17 | 111.5° | 127.9° |
| O16 | S15 | N14 | C13 | 40.1° | 51.1° |
| O16 | S15 | C18 | H11 | 180.0° | 51.6° |
| O16 | S15 | C18 | H12 | 60.0° | 171.6° |
| O16 | S15 | C18 | H13 | 60.0° | 68.4° |
| O16 | S15 | N14 | H15 | 81.0° | 129.0° |
| S15 | N14 | C13 | H15 | 121.1° | 180.0° |
| S15 | N14 | C13 | C12 | 174.0° | 165.0° |
| S15 | N14 | C13 | H4 | 54.0° | 45.0° |
| S15 | N14 | C13 | H5 | 66.0° | 75.0° |
| N14 | S15 | C18 | H11 | 57.0° | 60.0° |
| N14 | S15 | C18 | H12 | 62.9° | 60.0° |
| N14 | S15 | C18 | H13 | 177.0° | 180.0° |
| O17 | S15 | N14 | C13 | 71.5° | 179.0° |
| O17 | S15 | C18 | H11 | 66.9° | 171.6° |
| O17 | S15 | C18 | H12 | 173.1° | 51.6° |
| O17 | S15 | C18 | H13 | 53.0° | 68.4° |
| O17 | S15 | N14 | H15 | 167.5° | 1.1° |
| C05 | C04 | C03 | H7 | 180.0° | 180.0° |
| C05 | C04 | C03 | C02 | 178.7° | 121.8° |
| C05 | C04 | C03 | H6 | 89.9° | 121.8° |
| N14 | C13 | C12 | N11 | 71.6° | 180.0° |
| N14 | C13 | C12 | H4 | 120.0° | 120.0° |
| N14 | C13 | C12 | H5 | 120.0° | 120.1° |
| N14 | C13 | H4 | H5 | 119.9° | 120.0° |
| N14 | C13 | C12 | H9 | 167.9° | 60.0° |
| N14 | C13 | C12 | H10 | 48.9° | 60.0° |
| C04 | C03 | C02 | H6 | 91.4° | 116.5° |
| C04 | C03 | C02 | N11 | 177.4° | 180.0° |
| C04 | C03 | C02 | O01 | 0.1° | 0.0° |
| C03 | C04 | C05 | H8 | 178.9° | 180.0° |
| C03 | C02 | N11 | O01 | 177.3° | 179.9° |
| C03 | C02 | N11 | C12 | 177.5° | 180.0° |
| C02 | C03 | C04 | H7 | 1.3° | 58.2° |
| C03 | C02 | N11 | H14 | 2.5° | 0.1° |
| C02 | N11 | C12 | H14 | 180.0° | 179.9° |
| C02 | N11 | C12 | C13 | 66.4° | 180.0° |
| N11 | C02 | C03 | H6 | 91.2° | 63.5° |
| C02 | N11 | C12 | H9 | 54.2° | 59.9° |
| C02 | N11 | C12 | H10 | 173.1° | 60.0° |
| C12 | N11 | C02 | O01 | 0.2° | 0.1° |
| N11 | C12 | C13 | H9 | 120.5° | 120.0° |
| N11 | C12 | C13 | H10 | 120.5° | 120.0° |
| N11 | C12 | C13 | H4 | 168.4° | 60.0° |
| N11 | C12 | C13 | H5 | 48.4° | 59.9° |
| N11 | C12 | H9 | H10 | 118.4° | 119.9° |
| O01 | C02 | C03 | H6 | 91.5° | 116.5° |
| O01 | C02 | N11 | H14 | 179.8° | 180.0° |
| C12 | C13 | H4 | H5 | 119.9° | 119.9° |
| C13 | C12 | H9 | H10 | 118.4° | 120.0° |
| C13 | C12 | N11 | H14 | 113.6° | 0.0° |
| C12 | C13 | N14 | H15 | 65.0° | 15.0° |
| H1 | C10 | H2 | H3 | 120.0° | 119.9° |
| H4 | C13 | C12 | H9 | 47.9° | 60.0° |
| H4 | C13 | C12 | H10 | 71.1° | 180.0° |
| H4 | C13 | N14 | H15 | 175.0° | 135.0° |
| H5 | C13 | C12 | H9 | 72.1° | 180.0° |
| H5 | C13 | C12 | H10 | 168.9° | 60.1° |
| H5 | C13 | N14 | H15 | 55.0° | 105.0° |
| H6 | C03 | C04 | H7 | 90.0° | 58.2° |
| H7 | C04 | C05 | H8 | 1.1° | 0.0° |
| H9 | C12 | N11 | H14 | 125.8° | 120.0° |
| H10 | C12 | N11 | H14 | 6.9° | 120.1° |
| H11 | C18 | H12 | H13 | 120.0° | 120.0° |
