WG6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C03 | sing | 1.51Å | 1.55Å | |
| C02 | N09 | sing | 1.47Å | 1.45Å | |
| C02 | C01 | sing | 1.53Å | 1.52Å | |
| C03 | O04 | doub | 1.21Å | 1.18Å | |
| C03 | O05 | sing | 1.34Å | 1.42Å | |
| C06 | C07 | sing | 1.53Å | 1.56Å | |
| C06 | C08 | sing | 1.53Å | 1.53Å | |
| C06 | O05 | sing | 1.45Å | 1.43Å | |
| N09 | P10 | sing | 1.68Å | 1.75Å | |
| C13 | C14 | sing | 1.53Å | 1.56Å | |
| C13 | O12 | sing | 1.43Å | 1.44Å | |
| C14 | C15 | sing | 1.55Å | 1.55Å | |
| C14 | O18 | sing | 1.44Å | 1.30Å | |
| C15 | C16 | sing | 1.54Å | 1.59Å | |
| C15 | O29 | sing | 1.43Å | 1.33Å | |
| C16 | C17 | sing | 1.54Å | 1.28Å | |
| C16 | C27 | sing | 1.53Å | 1.53Å | |
| C16 | F28 | sing | 1.40Å | 1.45Å | |
| C17 | N19 | sing | 1.46Å | 1.47Å | |
| C20 | C21 | doub | 1.35Å | 1.50Å | |
| C20 | N19 | sing | 1.37Å | 1.46Å | |
| C21 | C22 | sing | 1.42Å | 1.49Å | |
| C22 | N24 | sing | 1.35Å | 1.46Å | |
| C22 | O23 | doub | 1.22Å | 1.20Å | |
| C25 | N19 | sing | 1.35Å | 1.49Å | |
| C25 | N24 | sing | 1.35Å | 1.49Å | |
| C25 | O26 | doub | 1.22Å | 1.19Å | |
| C31 | C32 | doub | 1.39Å | 1.38Å | Aromatic |
| C31 | C36 | sing | 1.39Å | 1.40Å | Aromatic |
| C31 | O30 | sing | 1.36Å | 1.41Å | |
| C32 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| C33 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | C35 | sing | 1.38Å | 1.38Å | Aromatic |
| C35 | C36 | doub | 1.38Å | 1.38Å | Aromatic |
| O11 | P10 | doub | 1.48Å | 1.46Å | |
| O12 | P10 | sing | 1.61Å | 1.67Å | |
| O30 | P10 | sing | 1.61Å | 1.67Å | |
| C02 | H1 | sing | 1.09Å | 1.10Å | |
| C06 | H2 | sing | 1.09Å | 1.10Å | |
| C07 | H3 | sing | 1.09Å | 1.10Å | |
| C07 | H4 | sing | 1.09Å | 1.10Å | |
| C07 | H5 | sing | 1.09Å | 1.10Å | |
| C08 | H6 | sing | 1.09Å | 1.10Å | |
| C08 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| N09 | H9 | sing | 1.01Å | 1.00Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.08Å | 1.08Å | |
| C21 | H17 | sing | 1.08Å | 1.08Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å | |
| C01 | H21 | sing | 1.09Å | 1.10Å | |
| C01 | H22 | sing | 1.09Å | 1.10Å | |
| C01 | H23 | sing | 1.09Å | 1.10Å | |
| C32 | H24 | sing | 1.08Å | 1.08Å | |
| C33 | H25 | sing | 1.08Å | 1.08Å | |
| C34 | H26 | sing | 1.08Å | 1.08Å | |
| C35 | H27 | sing | 1.08Å | 1.08Å | |
| C36 | H28 | sing | 1.08Å | 1.08Å | |
| N24 | H29 | sing | 0.97Å | 1.00Å | |
| O29 | H31 | sing | 0.97Å | 0.95Å | |
| C17 | O18 | sing | 1.44Å | 1.67Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C03 | C02 | N09 | 110.0° | 109.5° |
| C03 | C02 | C01 | 109.8° | 109.5° |
| C02 | C03 | O04 | 118.7° | 120.0° |
| C02 | C03 | O05 | 121.0° | 120.0° |
| C03 | C02 | H1 | 108.6° | 109.5° |
| N09 | C02 | C01 | 109.4° | 109.4° |
| C02 | N09 | P10 | 120.0° | 111.0° |
| N09 | C02 | H1 | 109.9° | 109.5° |
| C02 | N09 | H9 | 106.7° | 111.0° |
| C01 | C02 | H1 | 109.1° | 109.5° |
| C02 | C01 | H21 | 109.5° | 109.5° |
| C02 | C01 | H22 | 109.4° | 109.5° |
| C02 | C01 | H23 | 109.4° | 109.5° |
| O04 | C03 | O05 | 120.3° | 120.0° |
| C03 | O05 | C06 | 119.1° | 117.0° |
| C07 | C06 | C08 | 113.9° | 109.5° |
| C07 | C06 | O05 | 110.7° | 109.5° |
| C07 | C06 | H2 | 105.9° | 109.5° |
| C06 | C07 | H3 | 109.5° | 109.5° |
| C06 | C07 | H4 | 109.5° | 109.4° |
| C06 | C07 | H5 | 109.5° | 109.5° |
| C08 | C06 | O05 | 112.2° | 109.4° |
| C08 | C06 | H2 | 106.2° | 109.5° |
| C06 | C08 | H6 | 109.5° | 109.4° |
| C06 | C08 | H7 | 109.5° | 109.4° |
| C06 | C08 | H8 | 109.5° | 109.5° |
| O05 | C06 | H2 | 107.4° | 109.5° |
| N09 | P10 | O11 | 109.1° | 109.5° |
| N09 | P10 | O12 | 109.0° | 109.5° |
| N09 | P10 | O30 | 109.6° | 109.5° |
| P10 | N09 | H9 | 106.8° | 111.0° |
| C14 | C13 | O12 | 106.2° | 109.5° |
| C13 | C14 | C15 | 111.3° | 110.4° |
| C13 | C14 | O18 | 110.6° | 110.4° |
| C14 | C13 | H10 | 110.3° | 109.5° |
| C14 | C13 | H11 | 110.3° | 109.5° |
| C13 | C14 | H12 | 108.6° | 110.3° |
| C13 | O12 | P10 | 117.9° | 123.0° |
| O12 | C13 | H10 | 110.3° | 109.4° |
| O12 | C13 | H11 | 110.3° | 109.5° |
| C15 | C14 | O18 | 104.9° | 104.8° |
| C14 | C15 | C16 | 104.4° | 104.0° |
| C14 | C15 | O29 | 110.5° | 110.5° |
| C15 | C14 | H12 | 108.8° | 110.4° |
| C14 | C15 | H13 | 109.4° | 110.5° |
| O18 | C14 | H12 | 112.6° | 110.4° |
| C14 | O18 | C17 | 101.9° | 105.3° |
| C16 | C15 | O29 | 110.3° | 110.5° |
| C15 | C16 | C17 | 103.2° | 104.1° |
| C15 | C16 | C27 | 107.6° | 110.5° |
| C15 | C16 | F28 | 110.6° | 110.5° |
| C16 | C15 | H13 | 109.0° | 110.6° |
| O29 | C15 | H13 | 112.9° | 110.6° |
| C15 | O29 | H31 | 109.5° | 114.0° |
| C17 | C16 | C27 | 113.7° | 110.5° |
| C17 | C16 | F28 | 110.5° | 110.5° |
| C16 | C17 | N19 | 116.0° | 110.4° |
| C16 | C17 | H14 | 110.9° | 110.4° |
| C16 | C17 | O18 | 103.7° | 104.8° |
| C27 | C16 | F28 | 110.9° | 110.5° |
| C16 | C27 | H18 | 109.5° | 109.5° |
| C16 | C27 | H19 | 109.4° | 109.5° |
| C16 | C27 | H20 | 109.5° | 109.4° |
| C17 | N19 | C20 | 120.9° | 119.7° |
| C17 | N19 | C25 | 119.5° | 119.7° |
| N19 | C17 | H14 | 108.2° | 110.4° |
| N19 | C17 | O18 | 111.8° | 110.4° |
| C21 | C20 | N19 | 120.1° | 119.7° |
| C20 | C21 | C22 | 119.9° | 119.2° |
| C21 | C20 | H16 | 119.9° | 120.2° |
| C20 | C21 | H17 | 120.0° | 120.4° |
| C20 | N19 | C25 | 119.6° | 120.6° |
| N19 | C20 | H16 | 120.0° | 120.2° |
| C21 | C22 | N24 | 119.9° | 119.4° |
| C21 | C22 | O23 | 120.2° | 120.3° |
| C22 | C21 | H17 | 120.0° | 120.4° |
| N24 | C22 | O23 | 119.9° | 120.3° |
| C22 | N24 | C25 | 120.2° | 120.3° |
| C22 | N24 | H29 | 119.9° | 119.9° |
| N19 | C25 | N24 | 120.3° | 120.9° |
| N19 | C25 | O26 | 120.0° | 119.5° |
| N24 | C25 | O26 | 119.7° | 119.5° |
| C25 | N24 | H29 | 119.9° | 119.9° |
| C32 | C31 | C36 | 119.6° | 119.9° |
| C32 | C31 | O30 | 119.7° | 120.1° |
| C31 | C32 | C33 | 120.1° | 120.0° |
| C31 | C32 | H24 | 120.0° | 120.1° |
| C36 | C31 | O30 | 120.7° | 120.1° |
| C31 | C36 | C35 | 120.3° | 119.9° |
| C31 | C36 | H28 | 119.9° | 120.0° |
| C31 | O30 | P10 | 121.0° | 114.0° |
| C32 | C33 | C34 | 120.1° | 120.1° |
| C33 | C32 | H24 | 120.0° | 120.0° |
| C32 | C33 | H25 | 119.9° | 120.0° |
| C33 | C34 | C35 | 120.0° | 120.1° |
| C34 | C33 | H25 | 120.0° | 120.0° |
| C33 | C34 | H26 | 120.0° | 119.9° |
| C34 | C35 | C36 | 119.9° | 120.1° |
| C35 | C34 | H26 | 120.0° | 120.0° |
| C34 | C35 | H27 | 120.0° | 119.9° |
| C36 | C35 | H27 | 120.0° | 120.0° |
| C35 | C36 | H28 | 119.8° | 120.0° |
| O11 | P10 | O12 | 109.1° | 109.5° |
| O11 | P10 | O30 | 109.7° | 109.4° |
| O12 | P10 | O30 | 110.3° | 109.5° |
| H3 | C07 | H4 | 109.5° | 109.4° |
| H3 | C07 | H5 | 109.4° | 109.5° |
| H4 | C07 | H5 | 109.5° | 109.5° |
| H6 | C08 | H7 | 109.4° | 109.5° |
| H6 | C08 | H8 | 109.5° | 109.5° |
| H7 | C08 | H8 | 109.5° | 109.5° |
| H10 | C13 | H11 | 109.4° | 109.5° |
| H14 | C17 | O18 | 105.9° | 110.4° |
| H18 | C27 | H19 | 109.5° | 109.5° |
| H18 | C27 | H20 | 109.4° | 109.5° |
| H19 | C27 | H20 | 109.5° | 109.5° |
| H21 | C01 | H22 | 109.5° | 109.5° |
| H21 | C01 | H23 | 109.5° | 109.5° |
| H22 | C01 | H23 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C03 | C02 | N09 | C01 | 120.7° | 120.0° |
| C03 | C02 | N09 | H1 | 119.6° | 120.0° |
| C03 | C02 | C01 | H1 | 118.9° | 120.0° |
| C02 | C03 | O04 | O05 | 177.9° | 179.9° |
| C02 | C03 | O05 | C06 | 94.1° | 180.0° |
| C03 | C02 | N09 | P10 | 75.2° | 125.3° |
| C03 | C02 | N09 | H9 | 46.2° | 1.4° |
| C03 | C02 | C01 | H21 | 180.0° | 55.1° |
| C03 | C02 | C01 | H22 | 60.0° | 65.0° |
| C03 | C02 | C01 | H23 | 60.0° | 175.1° |
| N09 | C02 | C01 | H1 | 120.3° | 120.0° |
| N09 | C02 | C03 | O04 | 92.9° | 0.0° |
| N09 | C02 | C03 | O05 | 89.2° | 179.9° |
| C02 | N09 | P10 | H9 | 121.4° | 123.9° |
| C02 | N09 | P10 | O11 | 175.7° | 174.4° |
| C02 | N09 | P10 | O12 | 65.3° | 65.6° |
| C02 | N09 | P10 | O30 | 55.5° | 54.4° |
| N09 | C02 | C01 | H21 | 59.2° | 64.9° |
| N09 | C02 | C01 | H22 | 60.8° | 175.1° |
| N09 | C02 | C01 | H23 | 179.2° | 55.1° |
| C01 | C02 | C03 | O04 | 146.6° | 120.0° |
| C01 | C02 | C03 | O05 | 31.3° | 60.0° |
| C01 | C02 | N09 | P10 | 164.1° | 114.7° |
| C01 | C02 | N09 | H9 | 74.5° | 121.4° |
| C02 | C01 | H21 | H22 | 120.0° | 120.0° |
| C02 | C01 | H21 | H23 | 120.0° | 120.0° |
| C02 | C01 | H22 | H23 | 120.0° | 120.0° |
| O04 | C03 | O05 | C06 | 88.0° | 0.1° |
| O04 | C03 | C02 | H1 | 27.5° | 120.1° |
| C03 | O05 | C06 | C07 | 84.1° | 150.0° |
| C03 | O05 | C06 | C08 | 44.4° | 90.1° |
| O05 | C03 | C02 | H1 | 150.4° | 60.0° |
| C03 | O05 | C06 | H2 | 160.7° | 29.9° |
| C07 | C06 | C08 | O05 | 126.8° | 120.0° |
| C07 | C06 | C08 | H2 | 116.2° | 120.0° |
| C07 | C06 | O05 | H2 | 115.2° | 120.0° |
| C06 | C07 | H3 | H4 | 120.0° | 119.9° |
| C06 | C07 | H3 | H5 | 120.0° | 120.0° |
| C06 | C07 | H4 | H5 | 120.0° | 120.0° |
| C07 | C06 | C08 | H6 | 180.0° | 180.0° |
| C07 | C06 | C08 | H7 | 60.0° | 60.0° |
| C07 | C06 | C08 | H8 | 60.0° | 60.0° |
| C08 | C06 | O05 | H2 | 116.4° | 120.0° |
| C08 | C06 | C07 | H3 | 180.0° | 60.1° |
| C08 | C06 | C07 | H4 | 60.0° | 180.0° |
| C08 | C06 | C07 | H5 | 60.0° | 60.0° |
| C06 | C08 | H6 | H7 | 120.0° | 119.9° |
| C06 | C08 | H6 | H8 | 120.0° | 120.0° |
| C06 | C08 | H7 | H8 | 120.0° | 120.0° |
| O05 | C06 | C07 | H3 | 52.5° | 180.0° |
| O05 | C06 | C07 | H4 | 67.6° | 60.1° |
| O05 | C06 | C07 | H5 | 172.5° | 59.9° |
| O05 | C06 | C08 | H6 | 53.3° | 60.1° |
| O05 | C06 | C08 | H7 | 173.2° | 180.0° |
| O05 | C06 | C08 | H8 | 66.8° | 60.0° |
| N09 | P10 | O12 | C13 | 128.8° | 75.0° |
| N09 | P10 | O30 | C31 | 176.0° | 178.9° |
| N09 | P10 | O11 | O12 | 118.9° | 120.0° |
| N09 | P10 | O11 | O30 | 120.1° | 120.0° |
| N09 | P10 | O12 | O30 | 120.4° | 120.0° |
| P10 | N09 | C02 | H1 | 44.3° | 5.3° |
| C14 | C13 | O12 | H10 | 119.5° | 120.0° |
| C14 | C13 | O12 | H11 | 119.5° | 120.0° |
| C13 | C14 | C15 | O18 | 119.7° | 118.9° |
| C13 | C14 | C15 | H12 | 119.6° | 122.2° |
| C13 | C14 | O18 | H12 | 121.7° | 122.3° |
| C13 | C14 | C15 | C16 | 135.8° | 142.8° |
| C13 | C14 | C15 | O29 | 105.6° | 98.5° |
| C14 | C13 | O12 | P10 | 100.1° | 180.0° |
| C14 | C13 | H10 | H11 | 121.5° | 120.0° |
| C13 | C14 | C15 | H13 | 19.3° | 24.1° |
| C13 | C14 | O18 | C17 | 155.4° | 159.3° |
| O12 | C13 | C14 | C15 | 162.2° | 175.0° |
| O12 | C13 | C14 | O18 | 81.6° | 69.6° |
| C13 | O12 | P10 | O11 | 9.8° | 45.0° |
| C13 | O12 | P10 | O30 | 110.8° | 165.0° |
| O12 | C13 | H10 | H11 | 121.5° | 120.0° |
| O12 | C13 | C14 | H12 | 42.5° | 52.7° |
| C15 | C14 | O18 | H12 | 118.1° | 118.9° |
| C14 | C15 | C16 | O29 | 118.7° | 118.6° |
| C14 | C15 | C16 | H13 | 116.8° | 118.7° |
| C14 | C15 | O29 | H13 | 123.0° | 122.7° |
| C14 | C15 | C16 | C17 | 17.3° | 0.0° |
| C14 | C15 | C16 | C27 | 103.2° | 118.7° |
| C14 | C15 | C16 | F28 | 135.5° | 118.7° |
| C15 | C14 | C13 | H10 | 42.7° | 55.0° |
| C15 | C14 | C13 | H11 | 78.3° | 65.0° |
| C14 | C15 | O29 | H31 | 180.0° | 61.5° |
| C15 | C14 | O18 | C17 | 35.3° | 40.5° |
| O18 | C14 | C15 | C16 | 16.1° | 24.0° |
| O18 | C14 | C15 | O29 | 134.7° | 142.6° |
| C14 | O18 | C17 | C16 | 50.3° | 40.4° |
| C14 | O18 | C17 | N19 | 175.9° | 159.3° |
| O18 | C14 | C13 | H10 | 158.9° | 170.4° |
| O18 | C14 | C13 | H11 | 37.9° | 50.4° |
| O18 | C14 | C15 | H13 | 100.4° | 94.7° |
| C14 | O18 | C17 | H14 | 66.5° | 78.4° |
| C16 | C15 | O29 | H13 | 122.2° | 122.7° |
| C15 | C16 | C17 | C27 | 116.3° | 118.6° |
| C15 | C16 | C17 | F28 | 118.3° | 118.7° |
| C15 | C16 | C27 | F28 | 121.1° | 122.7° |
| C15 | C16 | C17 | N19 | 159.4° | 142.8° |
| C16 | C15 | C14 | H12 | 104.5° | 94.9° |
| C15 | C16 | C17 | H14 | 76.7° | 95.0° |
| C15 | C16 | C27 | H18 | 180.0° | 56.9° |
| C15 | C16 | C27 | H19 | 60.0° | 176.9° |
| C15 | C16 | C27 | H20 | 60.0° | 63.1° |
| C16 | C15 | O29 | H31 | 65.1° | 176.1° |
| C15 | C16 | C17 | O18 | 36.5° | 23.9° |
| O29 | C15 | C16 | C17 | 101.5° | 118.6° |
| O29 | C15 | C16 | C27 | 138.0° | 122.7° |
| O29 | C15 | C16 | F28 | 16.7° | 0.1° |
| O29 | C15 | C14 | H12 | 14.0° | 23.7° |
| C17 | C16 | C27 | F28 | 125.2° | 122.7° |
| C16 | C17 | N19 | H14 | 125.3° | 122.3° |
| C16 | C17 | N19 | O18 | 118.5° | 115.4° |
| C16 | C17 | N19 | C20 | 109.8° | 94.9° |
| C16 | C17 | N19 | C25 | 71.9° | 85.2° |
| C17 | C16 | C15 | H13 | 134.1° | 118.7° |
| C16 | C17 | H14 | O18 | 111.8° | 115.4° |
| C17 | C16 | C27 | H18 | 66.4° | 171.6° |
| C17 | C16 | C27 | H19 | 53.6° | 68.4° |
| C17 | C16 | C27 | H20 | 173.7° | 51.6° |
| C27 | C16 | C17 | N19 | 43.1° | 24.1° |
| C27 | C16 | C15 | H13 | 13.6° | 0.0° |
| C27 | C16 | C17 | H14 | 167.0° | 146.4° |
| C16 | C27 | H18 | H19 | 120.0° | 120.0° |
| C16 | C27 | H18 | H20 | 120.0° | 120.0° |
| C16 | C27 | H19 | H20 | 120.0° | 119.9° |
| C27 | C16 | C17 | O18 | 79.8° | 94.7° |
| F28 | C16 | C17 | N19 | 82.3° | 98.5° |
| F28 | C16 | C15 | H13 | 107.7° | 122.7° |
| F28 | C16 | C17 | H14 | 41.5° | 23.8° |
| F28 | C16 | C27 | H18 | 58.9° | 65.8° |
| F28 | C16 | C27 | H19 | 178.9° | 54.3° |
| F28 | C16 | C27 | H20 | 61.1° | 174.2° |
| F28 | C16 | C17 | O18 | 154.8° | 142.6° |
| C17 | N19 | C20 | C21 | 179.5° | 180.0° |
| C17 | N19 | C20 | C25 | 178.3° | 179.9° |
| C17 | N19 | C25 | N24 | 179.3° | 180.0° |
| C17 | N19 | C25 | O26 | 1.1° | 0.0° |
| N19 | C17 | H14 | O18 | 120.0° | 122.3° |
| C17 | N19 | C20 | H16 | 0.5° | 0.3° |
| C21 | C20 | N19 | H16 | 180.0° | 179.7° |
| C20 | C21 | C22 | H17 | 180.0° | 180.0° |
| C20 | C21 | C22 | N24 | 0.2° | 0.0° |
| C20 | C21 | C22 | O23 | 179.8° | 180.0° |
| C21 | C20 | N19 | C25 | 1.2° | 0.1° |
| N19 | C20 | C21 | C22 | 0.8° | 0.0° |
| C20 | N19 | C25 | N24 | 1.0° | 0.1° |
| C20 | N19 | C25 | O26 | 179.4° | 180.0° |
| C20 | N19 | C17 | H14 | 124.9° | 142.9° |
| N19 | C20 | C21 | H17 | 179.2° | 180.0° |
| C20 | N19 | C17 | O18 | 8.8° | 20.5° |
| C21 | C22 | N24 | O23 | 180.0° | 180.0° |
| C21 | C22 | N24 | C25 | 0.0° | 0.0° |
| C22 | C21 | C20 | H16 | 179.2° | 179.7° |
| C21 | C22 | N24 | H29 | 179.9° | 180.0° |
| C22 | N24 | C25 | N19 | 0.4° | 0.1° |
| C22 | N24 | C25 | H29 | 180.0° | 180.0° |
| C22 | N24 | C25 | O26 | 180.0° | 180.0° |
| N24 | C22 | C21 | H17 | 179.9° | 180.0° |
| O23 | C22 | N24 | C25 | 180.0° | 179.9° |
| O23 | C22 | C21 | H17 | 0.2° | 0.0° |
| O23 | C22 | N24 | H29 | 0.0° | 0.0° |
| N19 | C25 | N24 | O26 | 179.6° | 179.9° |
| C25 | N19 | C17 | H14 | 53.4° | 37.1° |
| C25 | N19 | C20 | H16 | 178.8° | 179.7° |
| N19 | C25 | N24 | H29 | 179.6° | 180.0° |
| C25 | N19 | C17 | O18 | 169.5° | 159.4° |
| O26 | C25 | N24 | H29 | 0.1° | 0.1° |
| C32 | C31 | C36 | O30 | 179.5° | 179.7° |
| C31 | C32 | C33 | H24 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.1° | 0.0° |
| C32 | C31 | C36 | C35 | 0.3° | 0.0° |
| C32 | C31 | O30 | P10 | 129.8° | 94.7° |
| C31 | C32 | C33 | H25 | 179.9° | 180.0° |
| C32 | C31 | C36 | H28 | 179.7° | 180.0° |
| C36 | C31 | C32 | C33 | 0.2° | 0.0° |
| C31 | C36 | C35 | C34 | 0.3° | 0.0° |
| C31 | C36 | C35 | H28 | 180.0° | 179.9° |
| C36 | C31 | O30 | P10 | 50.7° | 85.6° |
| C36 | C31 | C32 | H24 | 179.8° | 180.0° |
| C31 | C36 | C35 | H27 | 179.7° | 179.9° |
| O30 | C31 | C32 | C33 | 179.7° | 179.7° |
| O30 | C31 | C36 | C35 | 179.8° | 179.7° |
| C31 | O30 | P10 | O11 | 56.2° | 58.9° |
| C31 | O30 | P10 | O12 | 64.0° | 61.0° |
| O30 | C31 | C32 | H24 | 0.2° | 0.3° |
| O30 | C31 | C36 | H28 | 0.2° | 0.3° |
| C32 | C33 | C34 | H25 | 180.0° | 180.0° |
| C32 | C33 | C34 | C35 | 0.0° | 0.0° |
| C32 | C33 | C34 | H26 | 180.0° | 180.0° |
| C33 | C34 | C35 | H26 | 180.0° | 180.0° |
| C33 | C34 | C35 | C36 | 0.1° | 0.0° |
| C34 | C33 | C32 | H24 | 179.9° | 180.0° |
| C33 | C34 | C35 | H27 | 179.9° | 180.0° |
| C34 | C35 | C36 | H27 | 180.0° | 180.0° |
| C35 | C34 | C33 | H25 | 180.0° | 180.0° |
| C34 | C35 | C36 | H28 | 179.8° | 180.0° |
| C36 | C35 | C34 | H26 | 179.9° | 180.0° |
| O11 | P10 | O12 | O30 | 120.6° | 120.0° |
| O11 | P10 | N09 | H9 | 62.8° | 61.7° |
| O12 | P10 | N09 | H9 | 56.2° | 58.3° |
| P10 | O12 | C13 | H10 | 19.4° | 60.0° |
| P10 | O12 | C13 | H11 | 140.4° | 60.0° |
| O30 | P10 | N09 | H9 | 177.0° | 178.3° |
| H1 | C02 | N09 | H9 | 165.8° | 118.6° |
| H1 | C02 | C01 | H21 | 61.1° | 175.1° |
| H1 | C02 | C01 | H22 | 178.9° | 55.0° |
| H1 | C02 | C01 | H23 | 58.9° | 64.9° |
| H2 | C06 | C07 | H3 | 63.6° | 59.9° |
| H2 | C06 | C07 | H4 | 176.3° | 60.0° |
| H2 | C06 | C07 | H5 | 56.3° | 180.0° |
| H2 | C06 | C08 | H6 | 63.8° | 60.0° |
| H2 | C06 | C08 | H7 | 56.1° | 60.0° |
| H2 | C06 | C08 | H8 | 176.1° | 180.0° |
| H3 | C07 | H4 | H5 | 120.0° | 120.0° |
| H6 | C08 | H7 | H8 | 120.0° | 120.1° |
| H10 | C13 | C14 | H12 | 77.0° | 67.3° |
| H11 | C13 | C14 | H12 | 162.0° | 172.7° |
| H12 | C14 | C15 | H13 | 139.0° | 146.4° |
| H12 | C14 | O18 | C17 | 82.8° | 78.4° |
| H13 | C15 | O29 | H31 | 57.1° | 61.2° |
| H16 | C20 | C21 | H17 | 0.8° | 0.3° |
| H18 | C27 | H19 | H20 | 120.0° | 120.1° |
| H21 | C01 | H22 | H23 | 120.0° | 120.0° |
| H24 | C32 | C33 | H25 | 0.1° | 0.0° |
| H25 | C33 | C34 | H26 | 0.0° | 0.0° |
| H26 | C34 | C35 | H27 | 0.1° | 0.1° |
| H27 | C35 | C36 | H28 | 0.2° | 0.0° |
