BNW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4U | C4U | doub | 1.22Å | 1.25Å | |
| C4U | N3U | sing | 1.35Å | 1.39Å | |
| C4U | C5U | sing | 1.42Å | 1.43Å | |
| N3U | C2U | sing | 1.35Å | 1.38Å | |
| C5U | C6U | doub | 1.35Å | 1.37Å | |
| C2U | O2U | doub | 1.22Å | 1.22Å | |
| C2U | N1U | sing | 1.35Å | 1.39Å | |
| C6U | N1U | sing | 1.37Å | 1.37Å | |
| N1U | C1D | sing | 1.46Å | 1.49Å | |
| O7 | C7 | doub | 1.21Å | 1.23Å | |
| O1A | PA | doub | 1.48Å | 1.50Å | |
| C1D | O4D | sing | 1.44Å | 1.41Å | |
| C1D | C2D | sing | 1.55Å | 1.54Å | |
| O2A | PA | sing | 1.61Å | 1.55Å | |
| O4D | C4D | sing | 1.44Å | 1.44Å | |
| C8 | C7 | sing | 1.51Å | 1.50Å | |
| C7 | N2 | sing | 1.35Å | 1.35Å | |
| PA | O5D | sing | 1.61Å | 1.57Å | |
| PA | O3A | sing | 1.61Å | 1.54Å | |
| C2D | O2D | sing | 1.43Å | 1.41Å | |
| C2D | C3D | sing | 1.55Å | 1.53Å | |
| O5D | C5D | sing | 1.43Å | 1.44Å | |
| O1E | C1E | doub | 1.21Å | 1.31Å | |
| N2 | C2 | sing | 1.47Å | 1.45Å | |
| C4D | C5D | sing | 1.53Å | 1.51Å | |
| C4D | C3D | sing | 1.54Å | 1.51Å | |
| O3A | PB | sing | 1.61Å | 1.54Å | |
| C3D | O3D | sing | 1.43Å | 1.42Å | |
| C1E | O2E | sing | 1.34Å | 1.22Å | |
| C1E | C2E | sing | 1.51Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| O3 | C2E | sing | 1.43Å | 1.44Å | |
| O3 | C3 | sing | 1.43Å | 1.43Å | |
| C3E | C2E | sing | 1.53Å | 1.52Å | |
| PB | O1 | sing | 1.61Å | 1.55Å | |
| PB | O1B | doub | 1.48Å | 1.55Å | |
| PB | O2B | sing | 1.61Å | 1.50Å | |
| C1 | O1 | sing | 1.43Å | 1.41Å | |
| C1 | O5 | sing | 1.43Å | 1.42Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| O5 | C5 | sing | 1.43Å | 1.44Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4 | O4 | sing | 1.43Å | 1.43Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| O4 | P | sing | 1.61Å | 1.61Å | |
| O3P | P | doub | 1.48Å | 1.51Å | |
| O6 | C6 | sing | 1.43Å | 1.42Å | |
| P | O1P | sing | 1.61Å | 1.51Å | |
| P | O2P | sing | 1.61Å | 1.50Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| O6 | H8 | sing | 0.97Å | 0.95Å | |
| N2 | H9 | sing | 0.97Å | 1.00Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C1D | H13 | sing | 1.09Å | 1.10Å | |
| O2A | H14 | sing | 0.97Å | 0.95Å | |
| O2B | H15 | sing | 0.97Å | 0.95Å | |
| C2D | H16 | sing | 1.09Å | 1.10Å | |
| O2D | H17 | sing | 0.97Å | 0.95Å | |
| C2E | H18 | sing | 1.09Å | 1.10Å | |
| O2E | H19 | sing | 0.97Å | 0.95Å | |
| C3D | H20 | sing | 1.09Å | 1.10Å | |
| O3D | H21 | sing | 0.97Å | 0.95Å | |
| C3E | H22 | sing | 1.09Å | 1.10Å | |
| C3E | H23 | sing | 1.09Å | 1.10Å | |
| C3E | H24 | sing | 1.09Å | 1.10Å | |
| N3U | H25 | sing | 0.97Å | 1.00Å | |
| C4D | H26 | sing | 1.09Å | 1.10Å | |
| C5D | H27 | sing | 1.09Å | 1.10Å | |
| C5D | H28 | sing | 1.09Å | 1.10Å | |
| C5U | H29 | sing | 1.08Å | 1.08Å | |
| C6U | H30 | sing | 1.08Å | 1.08Å | |
| O1P | H31 | sing | 0.97Å | 0.95Å | |
| O2P | H32 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4U | C4U | N3U | 119.5° | 120.3° |
| O4U | C4U | C5U | 126.1° | 120.3° |
| N3U | C4U | C5U | 114.4° | 119.4° |
| C4U | N3U | C2U | 127.4° | 120.3° |
| C4U | N3U | H25 | 116.3° | 119.9° |
| C4U | C5U | C6U | 119.6° | 119.1° |
| C4U | C5U | H29 | 120.2° | 120.5° |
| N3U | C2U | O2U | 122.0° | 119.6° |
| N3U | C2U | N1U | 115.1° | 120.9° |
| C2U | N3U | H25 | 116.3° | 119.8° |
| C5U | C6U | N1U | 122.6° | 119.7° |
| C6U | C5U | H29 | 120.2° | 120.4° |
| C5U | C6U | H30 | 118.7° | 120.2° |
| O2U | C2U | N1U | 122.9° | 119.5° |
| C2U | N1U | C6U | 120.9° | 120.6° |
| C2U | N1U | C1D | 118.3° | 119.7° |
| C6U | N1U | C1D | 120.8° | 119.7° |
| N1U | C6U | H30 | 118.7° | 120.2° |
| N1U | C1D | O4D | 108.3° | 110.4° |
| N1U | C1D | C2D | 114.4° | 110.4° |
| N1U | C1D | H13 | 109.0° | 110.4° |
| O7 | C7 | C8 | 121.4° | 120.0° |
| O7 | C7 | N2 | 121.4° | 120.0° |
| O1A | PA | O2A | 111.1° | 109.5° |
| O1A | PA | O5D | 110.3° | 109.5° |
| O1A | PA | O3A | 109.4° | 109.5° |
| O4D | C1D | C2D | 106.8° | 104.8° |
| C1D | O4D | C4D | 109.8° | 105.3° |
| O4D | C1D | H13 | 110.1° | 110.4° |
| C1D | C2D | O2D | 111.8° | 110.5° |
| C1D | C2D | C3D | 101.9° | 104.0° |
| C2D | C1D | H13 | 108.3° | 110.4° |
| C1D | C2D | H16 | 109.1° | 110.5° |
| O2A | PA | O5D | 110.4° | 109.4° |
| O2A | PA | O3A | 105.8° | 109.4° |
| PA | O2A | H14 | 109.5° | 114.0° |
| O4D | C4D | C5D | 109.8° | 110.4° |
| O4D | C4D | C3D | 104.6° | 104.8° |
| O4D | C4D | H26 | 109.3° | 110.4° |
| C8 | C7 | N2 | 117.1° | 120.0° |
| C7 | C8 | H10 | 109.5° | 109.5° |
| C7 | C8 | H11 | 109.5° | 109.5° |
| C7 | C8 | H12 | 109.4° | 109.5° |
| C7 | N2 | C2 | 129.0° | 120.0° |
| C7 | N2 | H9 | 115.5° | 120.0° |
| O5D | PA | O3A | 109.7° | 109.5° |
| PA | O5D | C5D | 122.6° | 123.0° |
| PA | O3A | PB | 137.8° | 134.0° |
| O2D | C2D | C3D | 113.6° | 110.5° |
| O2D | C2D | H16 | 110.9° | 110.5° |
| C2D | O2D | H17 | 109.5° | 114.0° |
| C2D | C3D | C4D | 100.8° | 104.1° |
| C2D | C3D | O3D | 112.0° | 110.5° |
| C3D | C2D | H16 | 109.2° | 110.7° |
| C2D | C3D | H20 | 110.3° | 110.5° |
| O5D | C5D | C4D | 109.4° | 109.5° |
| O5D | C5D | H27 | 109.5° | 109.5° |
| O5D | C5D | H28 | 109.5° | 109.5° |
| O1E | C1E | O2E | 124.5° | 120.0° |
| O1E | C1E | C2E | 114.6° | 120.0° |
| N2 | C2 | C1 | 113.5° | 109.5° |
| N2 | C2 | C3 | 110.3° | 109.5° |
| N2 | C2 | H2 | 107.9° | 109.6° |
| C2 | N2 | H9 | 115.5° | 120.0° |
| C5D | C4D | C3D | 116.3° | 110.4° |
| C5D | C4D | H26 | 108.4° | 110.3° |
| C4D | C5D | H27 | 109.5° | 109.5° |
| C4D | C5D | H28 | 109.5° | 109.5° |
| C4D | C3D | O3D | 110.6° | 110.5° |
| C4D | C3D | H20 | 110.6° | 110.7° |
| C3D | C4D | H26 | 108.3° | 110.4° |
| O3A | PB | O1 | 105.6° | 109.4° |
| O3A | PB | O1B | 108.7° | 109.5° |
| O3A | PB | O2B | 111.0° | 109.5° |
| O3D | C3D | H20 | 112.0° | 110.5° |
| C3D | O3D | H21 | 109.5° | 114.0° |
| O2E | C1E | C2E | 120.9° | 120.0° |
| C1E | O2E | H19 | 109.5° | 117.0° |
| C1E | C2E | O3 | 113.5° | 109.5° |
| C1E | C2E | C3E | 109.5° | 109.4° |
| C1E | C2E | H18 | 108.5° | 109.4° |
| C1 | C2 | C3 | 110.9° | 109.1° |
| C2 | C1 | O1 | 109.0° | 109.5° |
| C2 | C1 | O5 | 112.4° | 109.4° |
| C2 | C1 | H1 | 107.3° | 109.5° |
| C1 | C2 | H2 | 106.9° | 109.5° |
| C2 | C3 | O3 | 106.7° | 109.5° |
| C2 | C3 | C4 | 112.8° | 109.1° |
| C3 | C2 | H2 | 107.0° | 109.6° |
| C2 | C3 | H3 | 108.9° | 109.6° |
| C2E | O3 | C3 | 116.9° | 114.0° |
| O3 | C2E | C3E | 107.1° | 109.5° |
| O3 | C2E | H18 | 109.7° | 109.5° |
| O3 | C3 | C4 | 109.2° | 109.5° |
| O3 | C3 | H3 | 110.2° | 109.5° |
| C3E | C2E | H18 | 108.5° | 109.4° |
| C2E | C3E | H22 | 109.5° | 109.4° |
| C2E | C3E | H23 | 109.5° | 109.5° |
| C2E | C3E | H24 | 109.4° | 109.5° |
| O1 | PB | O1B | 107.7° | 109.5° |
| O1 | PB | O2B | 111.7° | 109.5° |
| PB | O1 | C1 | 119.9° | 122.9° |
| O1B | PB | O2B | 111.8° | 109.5° |
| PB | O2B | H15 | 109.5° | 114.0° |
| O1 | C1 | O5 | 110.4° | 109.5° |
| O1 | C1 | H1 | 108.9° | 109.5° |
| C1 | O5 | C5 | 114.4° | 114.1° |
| O5 | C1 | H1 | 108.8° | 109.5° |
| C3 | C4 | C5 | 110.8° | 109.2° |
| C3 | C4 | O4 | 110.4° | 109.5° |
| C4 | C3 | H3 | 109.0° | 109.6° |
| C3 | C4 | H4 | 108.7° | 109.5° |
| O5 | C5 | C4 | 109.6° | 109.4° |
| O5 | C5 | C6 | 106.0° | 109.5° |
| O5 | C5 | H5 | 110.1° | 109.5° |
| C5 | C4 | O4 | 108.2° | 109.6° |
| C4 | C5 | C6 | 113.4° | 109.5° |
| C5 | C4 | H4 | 108.7° | 109.5° |
| C4 | C5 | H5 | 108.8° | 109.4° |
| C4 | O4 | P | 124.9° | 123.0° |
| O4 | C4 | H4 | 110.0° | 109.6° |
| C5 | C6 | O6 | 110.4° | 109.5° |
| C6 | C5 | H5 | 109.0° | 109.5° |
| C5 | C6 | H6 | 109.2° | 109.5° |
| C5 | C6 | H7 | 109.2° | 109.5° |
| O4 | P | O3P | 103.5° | 109.5° |
| O4 | P | O1P | 107.9° | 109.5° |
| O4 | P | O2P | 102.5° | 109.5° |
| O3P | P | O1P | 115.2° | 109.5° |
| O3P | P | O2P | 113.7° | 109.4° |
| O6 | C6 | H6 | 109.3° | 109.5° |
| O6 | C6 | H7 | 109.2° | 109.5° |
| C6 | O6 | H8 | 109.5° | 114.0° |
| O1P | P | O2P | 112.6° | 109.5° |
| P | O1P | H31 | 109.5° | 114.0° |
| P | O2P | H32 | 109.5° | 113.9° |
| H6 | C6 | H7 | 109.5° | 109.5° |
| H10 | C8 | H11 | 109.4° | 109.5° |
| H10 | C8 | H12 | 109.5° | 109.5° |
| H11 | C8 | H12 | 109.5° | 109.4° |
| H22 | C3E | H23 | 109.5° | 109.4° |
| H22 | C3E | H24 | 109.5° | 109.5° |
| H23 | C3E | H24 | 109.5° | 109.5° |
| H27 | C5D | H28 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4U | C4U | N3U | C5U | 179.7° | 180.0° |
| O4U | C4U | N3U | C2U | 179.6° | 180.0° |
| O4U | C4U | C5U | C6U | 179.5° | 179.8° |
| O4U | C4U | N3U | H25 | 0.4° | 0.0° |
| O4U | C4U | C5U | H29 | 0.5° | 0.0° |
| C4U | N3U | C2U | H25 | 180.0° | 180.0° |
| N3U | C4U | C5U | C6U | 0.2° | 0.3° |
| C4U | N3U | C2U | O2U | 180.0° | 180.0° |
| C4U | N3U | C2U | N1U | 0.2° | 0.0° |
| N3U | C4U | C5U | H29 | 179.9° | 180.0° |
| C5U | C4U | N3U | C2U | 0.1° | 0.0° |
| C4U | C5U | C6U | H29 | 180.0° | 179.7° |
| C4U | C5U | C6U | N1U | 0.0° | 0.5° |
| C5U | C4U | N3U | H25 | 179.9° | 180.0° |
| C4U | C5U | C6U | H30 | 180.0° | 180.0° |
| N3U | C2U | O2U | N1U | 179.9° | 180.0° |
| N3U | C2U | N1U | C6U | 0.3° | 0.2° |
| N3U | C2U | N1U | C1D | 179.5° | 180.0° |
| C5U | C6U | N1U | C2U | 0.3° | 0.5° |
| C5U | C6U | N1U | H30 | 180.0° | 179.6° |
| C5U | C6U | N1U | C1D | 179.4° | 179.7° |
| O2U | C2U | N1U | C6U | 179.8° | 179.7° |
| O2U | C2U | N1U | C1D | 0.6° | 0.0° |
| O2U | C2U | N3U | H25 | 0.1° | 0.1° |
| C2U | N1U | C6U | C1D | 179.1° | 179.8° |
| C2U | N1U | C1D | O4D | 149.2° | 126.4° |
| C2U | N1U | C1D | C2D | 91.9° | 118.2° |
| C2U | N1U | C1D | H13 | 29.5° | 4.2° |
| N1U | C2U | N3U | H25 | 179.8° | 180.0° |
| C2U | N1U | C6U | H30 | 179.7° | 180.0° |
| C6U | N1U | C1D | O4D | 31.6° | 53.3° |
| C6U | N1U | C1D | C2D | 87.3° | 62.1° |
| C6U | N1U | C1D | H13 | 151.3° | 175.6° |
| N1U | C6U | C5U | H29 | 180.0° | 179.8° |
| N1U | C1D | O4D | C2D | 123.6° | 118.8° |
| N1U | C1D | O4D | H13 | 119.0° | 122.3° |
| N1U | C1D | C2D | H13 | 121.7° | 122.3° |
| N1U | C1D | O4D | C4D | 125.4° | 159.3° |
| N1U | C1D | C2D | O2D | 141.2° | 98.6° |
| N1U | C1D | C2D | C3D | 97.2° | 142.8° |
| N1U | C1D | C2D | H16 | 18.1° | 24.0° |
| C1D | N1U | C6U | H30 | 0.5° | 0.2° |
| O7 | C7 | C8 | N2 | 179.5° | 180.0° |
| O7 | C7 | N2 | C2 | 172.1° | 0.0° |
| O7 | C7 | N2 | H9 | 7.9° | 180.0° |
| O7 | C7 | C8 | H10 | 0.0° | 90.0° |
| O7 | C7 | C8 | H11 | 120.0° | 30.0° |
| O7 | C7 | C8 | H12 | 120.0° | 150.0° |
| O1A | PA | O2A | O5D | 122.7° | 120.0° |
| O1A | PA | O2A | O3A | 118.7° | 120.0° |
| O1A | PA | O5D | O3A | 120.6° | 120.0° |
| O1A | PA | O5D | C5D | 148.1° | 55.0° |
| O1A | PA | O3A | PB | 128.0° | 45.0° |
| O1A | PA | O2A | H14 | 0.0° | 180.0° |
| O4D | C1D | C2D | H13 | 118.5° | 118.8° |
| O4D | C1D | C2D | O2D | 99.1° | 142.6° |
| O4D | C1D | C2D | C3D | 22.6° | 24.0° |
| C1D | O4D | C4D | C5D | 151.6° | 159.3° |
| C1D | O4D | C4D | C3D | 26.0° | 40.5° |
| O4D | C1D | C2D | H16 | 137.9° | 94.8° |
| C1D | O4D | C4D | H26 | 89.7° | 78.4° |
| C2D | C1D | O4D | C4D | 1.8° | 40.5° |
| C1D | C2D | O2D | C3D | 114.6° | 114.6° |
| C1D | C2D | O2D | H16 | 122.0° | 122.6° |
| C1D | C2D | C3D | H16 | 115.3° | 118.7° |
| C1D | C2D | C3D | C4D | 36.6° | 0.0° |
| C1D | C2D | C3D | O3D | 154.2° | 118.6° |
| C1D | C2D | O2D | H17 | 180.0° | 180.0° |
| C1D | C2D | C3D | H20 | 80.3° | 118.8° |
| O2A | PA | O5D | O3A | 116.3° | 120.0° |
| O2A | PA | O5D | C5D | 25.0° | 65.0° |
| O2A | PA | O3A | PB | 112.2° | 75.0° |
| O4D | C4D | C3D | C2D | 38.8° | 24.0° |
| O4D | C4D | C5D | O5D | 65.7° | 69.6° |
| O4D | C4D | C5D | C3D | 118.5° | 115.4° |
| O4D | C4D | C5D | H26 | 119.3° | 122.3° |
| O4D | C4D | C3D | H26 | 116.4° | 118.9° |
| O4D | C4D | C3D | O3D | 157.5° | 142.6° |
| C4D | O4D | C1D | H13 | 115.6° | 78.4° |
| O4D | C4D | C3D | H20 | 77.8° | 94.7° |
| O4D | C4D | C5D | H27 | 174.3° | 170.4° |
| O4D | C4D | C5D | H28 | 54.3° | 50.4° |
| C8 | C7 | N2 | C2 | 8.3° | 180.0° |
| C8 | C7 | N2 | H9 | 171.7° | 0.0° |
| C7 | C8 | H10 | H11 | 120.0° | 120.0° |
| C7 | C8 | H10 | H12 | 120.0° | 120.0° |
| C7 | C8 | H11 | H12 | 120.0° | 120.0° |
| C7 | N2 | C2 | H9 | 180.0° | 180.0° |
| C7 | N2 | C2 | C1 | 71.6° | 86.9° |
| C7 | N2 | C2 | C3 | 163.1° | 153.5° |
| C7 | N2 | C2 | H2 | 46.6° | 33.2° |
| N2 | C7 | C8 | H10 | 179.5° | 90.0° |
| N2 | C7 | C8 | H11 | 60.5° | 150.0° |
| N2 | C7 | C8 | H12 | 59.5° | 30.0° |
| PA | O5D | C5D | C4D | 144.9° | 180.0° |
| O5D | PA | O3A | PB | 7.0° | 165.0° |
| O5D | PA | O2A | H14 | 122.7° | 60.0° |
| PA | O5D | C5D | H27 | 95.1° | 60.0° |
| PA | O5D | C5D | H28 | 24.9° | 60.0° |
| O3A | PA | O5D | C5D | 91.3° | 175.0° |
| PA | O3A | PB | O1 | 175.6° | 165.0° |
| PA | O3A | PB | O1B | 60.3° | 45.0° |
| PA | O3A | PB | O2B | 63.2° | 75.0° |
| O3A | PA | O2A | H14 | 118.7° | 60.0° |
| O2D | C2D | C3D | H16 | 124.3° | 122.7° |
| O2D | C2D | C3D | C4D | 83.8° | 118.6° |
| O2D | C2D | C3D | O3D | 33.9° | 0.0° |
| O2D | C2D | C1D | H13 | 19.4° | 23.8° |
| O2D | C2D | C3D | H20 | 159.4° | 122.6° |
| C2D | C3D | C4D | C5D | 160.2° | 142.8° |
| C2D | C3D | C4D | O3D | 118.7° | 118.6° |
| C2D | C3D | C4D | H20 | 116.7° | 118.7° |
| C2D | C3D | O3D | H20 | 124.5° | 122.5° |
| C3D | C2D | C1D | H13 | 141.1° | 94.9° |
| C3D | C2D | O2D | H17 | 65.4° | 65.4° |
| C2D | C3D | O3D | H21 | 180.0° | 61.5° |
| C2D | C3D | C4D | H26 | 77.6° | 95.0° |
| O5D | C5D | C4D | H27 | 120.0° | 120.0° |
| O5D | C5D | C4D | H28 | 120.0° | 120.1° |
| O5D | C5D | C4D | C3D | 52.8° | 175.0° |
| O5D | C5D | C4D | H26 | 175.0° | 52.7° |
| O5D | C5D | H27 | H28 | 120.0° | 120.0° |
| O1E | C1E | O2E | C2E | 178.9° | 180.0° |
| O1E | C1E | C2E | O3 | 1.8° | 5.0° |
| O1E | C1E | C2E | C3E | 121.4° | 115.0° |
| O1E | C1E | C2E | H18 | 120.3° | 125.1° |
| O1E | C1E | O2E | H19 | 0.0° | 0.1° |
| N2 | C2 | C1 | C3 | 124.9° | 119.9° |
| N2 | C2 | C1 | H2 | 118.9° | 120.2° |
| N2 | C2 | C3 | H2 | 117.1° | 120.2° |
| N2 | C2 | C3 | O3 | 67.3° | 63.3° |
| N2 | C2 | C1 | O1 | 51.2° | 57.5° |
| N2 | C2 | C1 | O5 | 173.9° | 177.5° |
| N2 | C2 | C3 | C4 | 172.9° | 176.9° |
| N2 | C2 | C1 | H1 | 66.5° | 62.5° |
| N2 | C2 | C3 | H3 | 51.7° | 56.9° |
| C5D | C4D | C3D | H26 | 122.2° | 122.2° |
| C5D | C4D | C3D | O3D | 81.2° | 98.6° |
| C5D | C4D | C3D | H20 | 43.5° | 24.2° |
| C4D | C5D | H27 | H28 | 120.0° | 120.0° |
| C4D | C3D | O3D | H20 | 123.9° | 122.8° |
| C4D | C3D | C2D | H16 | 151.9° | 118.6° |
| C4D | C3D | O3D | H21 | 68.4° | 176.1° |
| C3D | C4D | C5D | H27 | 67.2° | 55.0° |
| C3D | C4D | C5D | H28 | 172.8° | 65.0° |
| O3A | PB | O1 | O1B | 116.1° | 120.0° |
| O3A | PB | O1 | O2B | 120.7° | 120.0° |
| O3A | PB | O1B | O2B | 122.9° | 120.0° |
| O3A | PB | O1 | C1 | 73.4° | 175.0° |
| O3A | PB | O2B | H15 | 121.6° | 60.0° |
| O3D | C3D | C2D | H16 | 90.5° | 122.7° |
| O3D | C3D | C4D | H26 | 41.1° | 23.6° |
| O2E | C1E | C2E | O3 | 179.1° | 175.0° |
| O2E | C1E | C2E | C3E | 59.6° | 64.9° |
| O2E | C1E | C2E | H18 | 58.7° | 55.0° |
| C1E | C2E | O3 | C3E | 121.0° | 120.0° |
| C1E | C2E | O3 | H18 | 121.5° | 120.0° |
| C1E | C2E | O3 | C3 | 83.9° | 151.4° |
| C1E | C2E | C3E | H18 | 118.3° | 119.9° |
| C2E | C1E | O2E | H19 | 178.9° | 180.0° |
| C1E | C2E | C3E | H22 | 180.0° | 64.6° |
| C1E | C2E | C3E | H23 | 60.0° | 175.5° |
| C1E | C2E | C3E | H24 | 60.0° | 55.4° |
| C1 | C2 | C3 | H2 | 116.2° | 119.9° |
| C1 | C2 | C3 | O3 | 166.0° | 176.8° |
| C2 | C1 | O1 | PB | 135.7° | 150.1° |
| C2 | C1 | O1 | O5 | 123.9° | 119.9° |
| C2 | C1 | O1 | H1 | 116.7° | 120.0° |
| C2 | C1 | O5 | H1 | 118.7° | 120.0° |
| C1 | C2 | C3 | C4 | 46.2° | 57.0° |
| C2 | C1 | O5 | C5 | 58.4° | 61.1° |
| C1 | C2 | C3 | H3 | 75.0° | 63.0° |
| C1 | C2 | N2 | H9 | 108.4° | 93.1° |
| C2 | C3 | O3 | C2E | 148.5° | 99.1° |
| C2 | C3 | O3 | C4 | 122.1° | 119.5° |
| C2 | C3 | O3 | H3 | 118.2° | 120.2° |
| C3 | C2 | C1 | O1 | 73.7° | 62.3° |
| C3 | C2 | C1 | O5 | 49.1° | 57.6° |
| C2 | C3 | C4 | H3 | 121.1° | 120.0° |
| C2 | C3 | C4 | C5 | 50.2° | 57.0° |
| C2 | C3 | C4 | O4 | 170.0° | 176.9° |
| C3 | C2 | C1 | H1 | 168.6° | 177.6° |
| C2 | C3 | C4 | H4 | 69.2° | 62.9° |
| C3 | C2 | N2 | H9 | 16.8° | 26.5° |
| O3 | C2E | C3E | H18 | 118.3° | 120.1° |
| C2E | O3 | C3 | C4 | 89.4° | 141.4° |
| C2E | O3 | C3 | H3 | 30.4° | 21.2° |
| O3 | C2E | C3E | H22 | 56.5° | 55.5° |
| O3 | C2E | C3E | H23 | 176.6° | 64.5° |
| O3 | C2E | C3E | H24 | 63.4° | 175.4° |
| C3 | O3 | C2E | C3E | 155.1° | 88.6° |
| O3 | C3 | C4 | H3 | 120.5° | 120.2° |
| O3 | C3 | C4 | C5 | 168.6° | 176.8° |
| O3 | C3 | C4 | O4 | 71.6° | 63.3° |
| O3 | C3 | C2 | H2 | 49.8° | 56.9° |
| O3 | C3 | C4 | H4 | 49.2° | 56.9° |
| C3 | O3 | C2E | H18 | 37.6° | 31.4° |
| C2E | C3E | H22 | H23 | 120.0° | 120.0° |
| C2E | C3E | H22 | H24 | 120.0° | 120.0° |
| C2E | C3E | H23 | H24 | 120.0° | 120.1° |
| O1 | PB | O1B | O2B | 123.1° | 120.0° |
| PB | O1 | C1 | O5 | 100.4° | 90.0° |
| PB | O1 | C1 | H1 | 19.0° | 30.1° |
| O1 | PB | O2B | H15 | 120.8° | 59.9° |
| O1B | PB | O1 | C1 | 170.6° | 55.0° |
| O1B | PB | O2B | H15 | 0.0° | 180.0° |
| O2B | PB | O1 | C1 | 47.4° | 65.0° |
| O1 | C1 | O5 | H1 | 119.5° | 120.1° |
| O1 | C1 | O5 | C5 | 63.5° | 58.8° |
| O1 | C1 | C2 | H2 | 170.1° | 177.7° |
| C1 | O5 | C5 | C4 | 61.3° | 61.1° |
| C1 | O5 | C5 | C6 | 176.0° | 178.9° |
| O5 | C1 | C2 | H2 | 67.2° | 62.4° |
| C1 | O5 | C5 | H5 | 58.3° | 58.8° |
| C3 | C4 | C5 | O5 | 55.7° | 57.6° |
| C3 | C4 | C5 | O4 | 121.2° | 119.9° |
| C3 | C4 | C5 | H4 | 119.4° | 119.9° |
| C3 | C4 | O4 | H4 | 120.0° | 120.2° |
| C3 | C4 | C5 | C6 | 173.9° | 177.6° |
| C3 | C4 | O4 | P | 134.6° | 118.6° |
| C4 | C3 | C2 | H2 | 70.0° | 62.9° |
| C3 | C4 | C5 | H5 | 64.7° | 62.4° |
| O5 | C5 | C4 | C6 | 118.2° | 120.0° |
| O5 | C5 | C4 | H5 | 120.4° | 120.0° |
| O5 | C5 | C4 | O4 | 176.8° | 177.5° |
| O5 | C5 | C6 | H5 | 118.4° | 120.1° |
| O5 | C5 | C6 | O6 | 60.1° | 65.1° |
| C5 | O5 | C1 | H1 | 177.1° | 178.9° |
| O5 | C5 | C4 | H4 | 63.8° | 62.3° |
| O5 | C5 | C6 | H6 | 60.0° | 175.0° |
| O5 | C5 | C6 | H7 | 179.8° | 54.9° |
| C5 | C4 | O4 | H4 | 118.6° | 120.1° |
| C4 | C5 | C6 | H5 | 121.3° | 119.9° |
| C5 | C4 | O4 | P | 103.9° | 121.7° |
| C4 | C5 | C6 | O6 | 60.2° | 175.0° |
| C5 | C4 | C3 | H3 | 70.9° | 63.0° |
| C4 | C5 | C6 | H6 | 179.7° | 55.0° |
| C4 | C5 | C6 | H7 | 60.0° | 65.0° |
| O4 | C4 | C5 | C6 | 64.9° | 62.5° |
| C4 | O4 | P | O3P | 114.7° | 55.0° |
| C4 | O4 | P | O1P | 7.7° | 175.0° |
| C4 | O4 | P | O2P | 126.8° | 65.0° |
| O4 | C4 | C3 | H3 | 48.9° | 56.9° |
| O4 | C4 | C5 | H5 | 56.5° | 57.5° |
| C5 | C6 | O6 | H6 | 120.1° | 120.0° |
| C5 | C6 | O6 | H7 | 120.1° | 120.0° |
| C6 | C5 | C4 | H4 | 54.5° | 57.7° |
| C5 | C6 | H6 | H7 | 119.6° | 120.0° |
| C5 | C6 | O6 | H8 | 180.0° | 180.0° |
| O4 | P | O3P | O1P | 117.5° | 120.0° |
| O4 | P | O3P | O2P | 110.4° | 120.0° |
| O4 | P | O1P | O2P | 112.4° | 120.0° |
| P | O4 | C4 | H4 | 14.6° | 1.5° |
| O4 | P | O1P | H31 | 115.0° | 180.0° |
| O4 | P | O2P | H32 | 111.1° | 65.3° |
| O3P | P | O1P | O2P | 132.6° | 120.0° |
| O3P | P | O1P | H31 | 0.0° | 60.0° |
| O3P | P | O2P | H32 | 0.0° | 174.7° |
| O6 | C6 | C5 | H5 | 178.5° | 55.0° |
| O6 | C6 | H6 | H7 | 119.6° | 120.0° |
| O1P | P | O2P | H32 | 133.3° | 54.7° |
| O2P | P | O1P | H31 | 132.6° | 60.0° |
| H1 | C1 | C2 | H2 | 52.3° | 57.7° |
| H2 | C2 | C3 | H3 | 168.8° | 177.1° |
| H2 | C2 | N2 | H9 | 133.4° | 146.8° |
| H3 | C3 | C4 | H4 | 169.7° | 177.1° |
| H4 | C4 | C5 | H5 | 175.9° | 177.7° |
| H5 | C5 | C6 | H6 | 58.4° | 65.0° |
| H5 | C5 | C6 | H7 | 61.3° | 175.0° |
| H6 | C6 | O6 | H8 | 59.8° | 60.0° |
| H7 | C6 | O6 | H8 | 59.9° | 60.0° |
| H10 | C8 | H11 | H12 | 120.0° | 120.0° |
| H13 | C1D | C2D | H16 | 103.6° | 146.3° |
| H16 | C2D | O2D | H17 | 58.0° | 57.5° |
| H16 | C2D | C3D | H20 | 35.0° | 0.2° |
| H18 | C2E | C3E | H22 | 61.8° | 175.5° |
| H18 | C2E | C3E | H23 | 58.3° | 55.6° |
| H18 | C2E | C3E | H24 | 178.3° | 64.5° |
| H20 | C3D | O3D | H21 | 55.4° | 61.0° |
| H20 | C3D | C4D | H26 | 165.8° | 146.4° |
| H22 | C3E | H23 | H24 | 120.0° | 120.0° |
| H26 | C4D | C5D | H27 | 55.0° | 67.3° |
| H26 | C4D | C5D | H28 | 65.0° | 172.8° |
| H29 | C5U | C6U | H30 | 0.0° | 0.2° |
