S9Y
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C40 | C39 | sing | 1.53Å | 1.52Å | |
| C39 | C38 | sing | 1.53Å | 1.53Å | |
| C38 | C37 | sing | 1.53Å | 1.54Å | |
| C37 | C36 | sing | 1.53Å | 1.54Å | |
| C36 | C35 | sing | 1.53Å | 1.55Å | |
| C35 | C34 | sing | 1.53Å | 1.55Å | |
| C34 | C33 | sing | 1.53Å | 1.55Å | |
| C33 | C32 | sing | 1.53Å | 1.56Å | |
| C32 | C31 | sing | 1.51Å | 1.53Å | |
| C31 | O31 | doub | 1.21Å | 1.22Å | |
| C31 | O2 | sing | 1.34Å | 1.37Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| O2 | C2 | sing | 1.45Å | 1.44Å | |
| C2 | C1 | sing | 1.53Å | 1.56Å | |
| C1 | O3P | sing | 1.43Å | 1.39Å | |
| O3P | P | sing | 1.61Å | 1.69Å | |
| C6 | N1 | sing | 1.47Å | 1.51Å | |
| O4 | P | doub | 1.48Å | 1.48Å | |
| O5 | P | sing | 1.61Å | 1.80Å | |
| O5 | C4 | sing | 1.43Å | 1.36Å | |
| P | O1 | sing | 1.61Å | 1.48Å | |
| C4 | C5 | sing | 1.53Å | 1.56Å | |
| N1 | C8 | sing | 1.47Å | 1.51Å | |
| N1 | C5 | sing | 1.47Å | 1.54Å | |
| N1 | C7 | sing | 1.47Å | 1.52Å | |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C32 | H7 | sing | 1.09Å | 1.10Å | |
| C32 | H8 | sing | 1.09Å | 1.10Å | |
| C33 | H9 | sing | 1.09Å | 1.10Å | |
| C33 | H10 | sing | 1.09Å | 1.10Å | |
| C34 | H11 | sing | 1.09Å | 1.10Å | |
| C34 | H12 | sing | 1.09Å | 1.10Å | |
| C35 | H13 | sing | 1.09Å | 1.10Å | |
| C35 | H14 | sing | 1.09Å | 1.10Å | |
| C36 | H15 | sing | 1.09Å | 1.10Å | |
| C36 | H16 | sing | 1.09Å | 1.10Å | |
| C37 | H17 | sing | 1.09Å | 1.10Å | |
| C37 | H18 | sing | 1.09Å | 1.10Å | |
| C38 | H19 | sing | 1.09Å | 1.10Å | |
| C38 | H20 | sing | 1.09Å | 1.10Å | |
| C39 | H21 | sing | 1.09Å | 1.10Å | |
| C39 | H22 | sing | 1.09Å | 1.10Å | |
| C40 | H23 | sing | 1.09Å | 1.10Å | |
| C40 | H24 | sing | 1.09Å | 1.10Å | |
| C40 | H25 | sing | 1.09Å | 1.10Å | |
| O1 | H26 | sing | 0.97Å | 0.95Å | |
| C4 | H27 | sing | 1.09Å | 1.10Å | |
| C4 | H28 | sing | 1.09Å | 1.10Å | |
| C5 | H29 | sing | 1.09Å | 1.10Å | |
| C5 | H30 | sing | 1.09Å | 1.10Å | |
| C6 | H31 | sing | 1.09Å | 1.10Å | |
| C6 | H32 | sing | 1.09Å | 1.10Å | |
| C6 | H33 | sing | 1.09Å | 1.10Å | |
| C7 | H34 | sing | 1.09Å | 1.10Å | |
| C7 | H35 | sing | 1.09Å | 1.10Å | |
| C7 | H36 | sing | 1.09Å | 1.10Å | |
| C8 | H37 | sing | 1.09Å | 1.10Å | |
| C8 | H38 | sing | 1.09Å | 1.10Å | |
| C8 | H39 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C40 | C39 | C38 | 113.6° | 109.4° |
| C40 | C39 | H21 | 108.4° | 109.5° |
| C40 | C39 | H22 | 108.5° | 109.4° |
| C39 | C40 | H23 | 109.5° | 109.5° |
| C39 | C40 | H24 | 109.5° | 109.5° |
| C39 | C40 | H25 | 109.4° | 109.4° |
| C39 | C38 | C37 | 112.6° | 109.4° |
| C39 | C38 | H19 | 108.7° | 109.5° |
| C39 | C38 | H20 | 108.7° | 109.5° |
| C38 | C39 | H21 | 108.4° | 109.5° |
| C38 | C39 | H22 | 108.4° | 109.5° |
| C38 | C37 | C36 | 114.1° | 109.5° |
| C38 | C37 | H17 | 108.3° | 109.5° |
| C38 | C37 | H18 | 108.3° | 109.4° |
| C37 | C38 | H19 | 108.7° | 109.5° |
| C37 | C38 | H20 | 108.7° | 109.5° |
| C37 | C36 | C35 | 115.0° | 109.5° |
| C37 | C36 | H15 | 108.1° | 109.5° |
| C37 | C36 | H16 | 108.0° | 109.5° |
| C36 | C37 | H17 | 108.3° | 109.5° |
| C36 | C37 | H18 | 108.3° | 109.4° |
| C36 | C35 | C34 | 115.2° | 109.5° |
| C36 | C35 | H13 | 108.0° | 109.5° |
| C36 | C35 | H14 | 108.0° | 109.5° |
| C35 | C36 | H15 | 108.1° | 109.5° |
| C35 | C36 | H16 | 108.1° | 109.5° |
| C35 | C34 | C33 | 115.1° | 109.5° |
| C35 | C34 | H11 | 108.0° | 109.5° |
| C35 | C34 | H12 | 108.0° | 109.4° |
| C34 | C35 | H13 | 108.0° | 109.5° |
| C34 | C35 | H14 | 108.0° | 109.4° |
| C34 | C33 | C32 | 115.8° | 109.4° |
| C34 | C33 | H9 | 107.9° | 109.4° |
| C34 | C33 | H10 | 107.8° | 109.4° |
| C33 | C34 | H11 | 108.0° | 109.5° |
| C33 | C34 | H12 | 108.0° | 109.5° |
| C33 | C32 | C31 | 114.4° | 109.5° |
| C33 | C32 | H7 | 108.2° | 109.5° |
| C33 | C32 | H8 | 108.2° | 109.5° |
| C32 | C33 | H9 | 107.9° | 109.5° |
| C32 | C33 | H10 | 107.9° | 109.5° |
| C32 | C31 | O31 | 124.5° | 120.0° |
| C32 | C31 | O2 | 116.3° | 120.0° |
| C31 | C32 | H7 | 108.2° | 109.5° |
| C31 | C32 | H8 | 108.2° | 109.5° |
| O31 | C31 | O2 | 119.2° | 120.0° |
| C31 | O2 | C2 | 119.4° | 117.0° |
| C3 | C2 | O2 | 110.8° | 109.5° |
| C3 | C2 | C1 | 107.9° | 109.5° |
| C2 | C3 | H1 | 109.5° | 109.5° |
| C2 | C3 | H2 | 109.5° | 109.5° |
| C2 | C3 | H3 | 109.5° | 109.5° |
| C3 | C2 | H4 | 109.7° | 109.5° |
| O2 | C2 | C1 | 108.2° | 109.5° |
| O2 | C2 | H4 | 111.0° | 109.5° |
| C2 | C1 | O3P | 108.9° | 109.5° |
| C1 | C2 | H4 | 109.2° | 109.5° |
| C2 | C1 | H5 | 109.6° | 109.5° |
| C2 | C1 | H6 | 109.6° | 109.5° |
| C1 | O3P | P | 122.3° | 123.1° |
| O3P | C1 | H5 | 109.6° | 109.5° |
| O3P | C1 | H6 | 109.6° | 109.4° |
| O3P | P | O4 | 108.6° | 109.4° |
| O3P | P | O5 | 112.4° | 109.5° |
| O3P | P | O1 | 108.0° | 109.5° |
| C6 | N1 | C8 | 109.5° | 109.5° |
| C6 | N1 | C5 | 110.7° | 109.5° |
| C6 | N1 | C7 | 107.8° | 109.5° |
| N1 | C6 | H31 | 109.5° | 109.4° |
| N1 | C6 | H32 | 109.5° | 109.5° |
| N1 | C6 | H33 | 109.5° | 109.4° |
| O4 | P | O5 | 98.1° | 109.5° |
| O4 | P | O1 | 129.6° | 109.5° |
| P | O5 | C4 | 117.7° | 123.0° |
| O5 | P | O1 | 98.7° | 109.5° |
| O5 | C4 | C5 | 106.3° | 109.5° |
| O5 | C4 | H27 | 110.2° | 109.4° |
| O5 | C4 | H28 | 110.3° | 109.5° |
| P | O1 | H26 | 109.5° | 114.0° |
| C4 | C5 | N1 | 113.3° | 109.5° |
| C5 | C4 | H27 | 110.3° | 109.5° |
| C5 | C4 | H28 | 110.2° | 109.5° |
| C4 | C5 | H29 | 108.5° | 109.5° |
| C4 | C5 | H30 | 108.5° | 109.4° |
| C8 | N1 | C5 | 111.0° | 109.4° |
| C8 | N1 | C7 | 107.6° | 109.5° |
| N1 | C8 | H37 | 109.5° | 109.5° |
| N1 | C8 | H38 | 109.5° | 109.5° |
| N1 | C8 | H39 | 109.4° | 109.5° |
| C5 | N1 | C7 | 110.1° | 109.5° |
| N1 | C5 | H29 | 108.5° | 109.5° |
| N1 | C5 | H30 | 108.5° | 109.5° |
| N1 | C7 | H34 | 109.5° | 109.4° |
| N1 | C7 | H35 | 109.5° | 109.5° |
| N1 | C7 | H36 | 109.5° | 109.5° |
| H1 | C3 | H2 | 109.4° | 109.5° |
| H1 | C3 | H3 | 109.4° | 109.5° |
| H2 | C3 | H3 | 109.5° | 109.5° |
| H5 | C1 | H6 | 109.5° | 109.4° |
| H7 | C32 | H8 | 109.5° | 109.4° |
| H9 | C33 | H10 | 109.5° | 109.5° |
| H11 | C34 | H12 | 109.5° | 109.4° |
| H13 | C35 | H14 | 109.5° | 109.4° |
| H15 | C36 | H16 | 109.5° | 109.4° |
| H17 | C37 | H18 | 109.5° | 109.5° |
| H19 | C38 | H20 | 109.5° | 109.5° |
| H21 | C39 | H22 | 109.5° | 109.5° |
| H23 | C40 | H24 | 109.5° | 109.5° |
| H23 | C40 | H25 | 109.5° | 109.5° |
| H24 | C40 | H25 | 109.4° | 109.5° |
| H27 | C4 | H28 | 109.5° | 109.5° |
| H29 | C5 | H30 | 109.5° | 109.5° |
| H31 | C6 | H32 | 109.4° | 109.5° |
| H31 | C6 | H33 | 109.5° | 109.5° |
| H32 | C6 | H33 | 109.5° | 109.5° |
| H34 | C7 | H35 | 109.5° | 109.5° |
| H34 | C7 | H36 | 109.4° | 109.5° |
| H35 | C7 | H36 | 109.5° | 109.5° |
| H37 | C8 | H38 | 109.4° | 109.5° |
| H37 | C8 | H39 | 109.5° | 109.5° |
| H38 | C8 | H39 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C40 | C39 | C38 | H21 | 120.6° | 120.0° |
| C40 | C39 | C38 | H22 | 120.6° | 119.9° |
| C40 | C39 | C38 | C37 | 159.8° | 180.0° |
| C40 | C39 | C38 | H19 | 39.3° | 60.0° |
| C40 | C39 | C38 | H20 | 79.8° | 60.0° |
| C40 | C39 | H21 | H22 | 118.1° | 120.0° |
| C39 | C40 | H23 | H24 | 120.0° | 120.1° |
| C39 | C40 | H23 | H25 | 120.0° | 120.0° |
| C39 | C40 | H24 | H25 | 120.0° | 120.0° |
| C39 | C38 | C37 | H19 | 120.5° | 120.0° |
| C39 | C38 | C37 | H20 | 120.4° | 120.0° |
| C39 | C38 | C37 | C36 | 144.4° | 180.0° |
| C39 | C38 | C37 | H17 | 94.9° | 60.0° |
| C39 | C38 | C37 | H18 | 23.7° | 60.0° |
| C39 | C38 | H19 | H20 | 118.6° | 120.0° |
| C38 | C39 | H21 | H22 | 118.1° | 120.0° |
| C38 | C39 | C40 | H23 | 180.0° | 60.0° |
| C38 | C39 | C40 | H24 | 60.0° | 60.0° |
| C38 | C39 | C40 | H25 | 60.0° | 180.0° |
| C38 | C37 | C36 | H17 | 120.7° | 120.1° |
| C38 | C37 | C36 | H18 | 120.7° | 120.0° |
| C38 | C37 | C36 | C35 | 148.7° | 180.0° |
| C38 | C37 | C36 | H15 | 28.0° | 59.9° |
| C38 | C37 | C36 | H16 | 90.5° | 60.0° |
| C38 | C37 | H17 | H18 | 117.9° | 120.0° |
| C37 | C38 | H19 | H20 | 118.6° | 120.0° |
| C37 | C38 | C39 | H21 | 79.6° | 60.0° |
| C37 | C38 | C39 | H22 | 39.1° | 60.1° |
| C37 | C36 | C35 | H15 | 120.8° | 120.1° |
| C37 | C36 | C35 | H16 | 120.8° | 120.0° |
| C37 | C36 | C35 | C34 | 139.2° | 180.0° |
| C37 | C36 | C35 | H13 | 100.0° | 59.9° |
| C37 | C36 | C35 | H14 | 18.3° | 60.1° |
| C37 | C36 | H15 | H16 | 117.5° | 120.0° |
| C36 | C37 | H17 | H18 | 117.8° | 120.0° |
| C36 | C37 | C38 | H19 | 23.9° | 60.0° |
| C36 | C37 | C38 | H20 | 95.2° | 60.0° |
| C36 | C35 | C34 | H13 | 120.8° | 120.1° |
| C36 | C35 | C34 | H14 | 120.8° | 120.0° |
| C36 | C35 | C34 | C33 | 151.7° | 180.0° |
| C36 | C35 | C34 | H11 | 30.8° | 59.9° |
| C36 | C35 | C34 | H12 | 87.5° | 60.0° |
| C36 | C35 | H13 | H14 | 117.4° | 120.0° |
| C35 | C36 | H15 | H16 | 117.5° | 120.0° |
| C35 | C36 | C37 | H17 | 90.6° | 59.9° |
| C35 | C36 | C37 | H18 | 28.0° | 60.1° |
| C35 | C34 | C33 | H11 | 120.8° | 120.0° |
| C35 | C34 | C33 | H12 | 120.8° | 119.9° |
| C35 | C34 | C33 | C32 | 135.0° | 180.0° |
| C35 | C34 | C33 | H9 | 104.0° | 60.0° |
| C35 | C34 | C33 | H10 | 14.1° | 60.0° |
| C35 | C34 | H11 | H12 | 117.4° | 119.9° |
| C34 | C35 | H13 | H14 | 117.4° | 119.9° |
| C34 | C35 | C36 | H15 | 18.4° | 59.9° |
| C34 | C35 | C36 | H16 | 100.0° | 60.0° |
| C34 | C33 | C32 | H9 | 120.9° | 120.0° |
| C34 | C33 | C32 | H10 | 120.9° | 119.9° |
| C34 | C33 | C32 | C31 | 161.3° | 180.0° |
| C34 | C33 | C32 | H7 | 40.6° | 60.0° |
| C34 | C33 | C32 | H8 | 78.0° | 60.0° |
| C34 | C33 | H9 | H10 | 117.1° | 120.0° |
| C33 | C34 | H11 | H12 | 117.5° | 120.1° |
| C33 | C34 | C35 | H13 | 87.5° | 59.9° |
| C33 | C34 | C35 | H14 | 30.8° | 60.0° |
| C33 | C32 | C31 | H7 | 120.7° | 120.0° |
| C33 | C32 | C31 | H8 | 120.7° | 120.0° |
| C33 | C32 | C31 | O31 | 17.7° | 0.0° |
| C33 | C32 | C31 | O2 | 162.3° | 180.0° |
| C33 | C32 | H7 | H8 | 117.8° | 120.0° |
| C32 | C33 | H9 | H10 | 117.2° | 120.1° |
| C32 | C33 | C34 | H11 | 14.2° | 60.0° |
| C32 | C33 | C34 | H12 | 104.1° | 60.0° |
| C32 | C31 | O31 | O2 | 180.0° | 180.0° |
| C32 | C31 | O2 | C2 | 151.8° | 180.0° |
| C31 | C32 | H7 | H8 | 117.8° | 120.0° |
| C31 | C32 | C33 | H9 | 77.8° | 60.0° |
| C31 | C32 | C33 | H10 | 40.4° | 60.0° |
| O31 | C31 | O2 | C2 | 28.2° | 0.0° |
| O31 | C31 | C32 | H7 | 138.4° | 120.0° |
| O31 | C31 | C32 | H8 | 103.0° | 120.1° |
| C31 | O2 | C2 | C3 | 113.3° | 90.0° |
| C31 | O2 | C2 | C1 | 128.6° | 150.0° |
| C31 | O2 | C2 | H4 | 8.9° | 30.0° |
| O2 | C31 | C32 | H7 | 41.6° | 60.0° |
| O2 | C31 | C32 | H8 | 77.0° | 60.0° |
| C3 | C2 | O2 | C1 | 118.1° | 120.0° |
| C3 | C2 | O2 | H4 | 122.2° | 120.0° |
| C3 | C2 | C1 | H4 | 119.2° | 120.0° |
| C3 | C2 | C1 | O3P | 61.8° | 55.0° |
| C2 | C3 | H1 | H2 | 120.0° | 120.0° |
| C2 | C3 | H1 | H3 | 120.0° | 120.0° |
| C2 | C3 | H2 | H3 | 120.0° | 120.0° |
| C3 | C2 | C1 | H5 | 178.3° | 175.0° |
| C3 | C2 | C1 | H6 | 58.1° | 65.0° |
| O2 | C2 | C1 | H4 | 120.9° | 120.0° |
| O2 | C2 | C1 | O3P | 58.1° | 65.0° |
| O2 | C2 | C3 | H1 | 180.0° | 60.0° |
| O2 | C2 | C3 | H2 | 60.0° | 180.0° |
| O2 | C2 | C3 | H3 | 60.0° | 60.0° |
| O2 | C2 | C1 | H5 | 61.8° | 55.1° |
| O2 | C2 | C1 | H6 | 178.0° | 175.0° |
| C2 | C1 | O3P | H5 | 119.9° | 120.1° |
| C2 | C1 | O3P | H6 | 119.9° | 120.0° |
| C2 | C1 | O3P | P | 168.0° | 180.0° |
| C1 | C2 | C3 | H1 | 61.8° | 60.0° |
| C1 | C2 | C3 | H2 | 178.2° | 60.0° |
| C1 | C2 | C3 | H3 | 58.2° | 180.0° |
| C2 | C1 | H5 | H6 | 120.3° | 120.0° |
| C1 | O3P | P | O4 | 90.2° | 55.0° |
| C1 | O3P | P | O5 | 162.3° | 175.0° |
| C1 | O3P | P | O1 | 54.5° | 65.0° |
| O3P | C1 | C2 | H4 | 179.0° | 175.0° |
| O3P | C1 | H5 | H6 | 120.2° | 119.9° |
| O3P | P | O4 | O5 | 117.0° | 120.0° |
| O3P | P | O4 | O1 | 134.5° | 120.0° |
| O3P | P | O5 | O1 | 113.6° | 120.1° |
| O3P | P | O5 | C4 | 73.0° | 175.0° |
| P | O3P | C1 | H5 | 72.1° | 59.9° |
| P | O3P | C1 | H6 | 48.1° | 60.0° |
| O3P | P | O1 | H26 | 134.7° | 60.0° |
| C6 | N1 | C5 | C4 | 53.0° | 174.4° |
| C6 | N1 | C8 | C5 | 122.6° | 120.0° |
| C6 | N1 | C8 | C7 | 116.9° | 120.0° |
| C6 | N1 | C5 | C7 | 119.1° | 120.1° |
| C6 | N1 | C5 | H29 | 173.6° | 54.4° |
| C6 | N1 | C5 | H30 | 67.5° | 65.6° |
| N1 | C6 | H31 | H32 | 120.0° | 120.0° |
| N1 | C6 | H31 | H33 | 120.0° | 120.0° |
| N1 | C6 | H32 | H33 | 120.0° | 120.0° |
| C6 | N1 | C7 | H34 | 180.0° | 48.9° |
| C6 | N1 | C7 | H35 | 60.0° | 71.0° |
| C6 | N1 | C7 | H36 | 60.0° | 168.9° |
| C6 | N1 | C8 | H37 | 180.0° | 60.0° |
| C6 | N1 | C8 | H38 | 60.0° | 60.0° |
| C6 | N1 | C8 | H39 | 60.0° | 180.0° |
| O4 | P | O5 | O1 | 132.3° | 120.0° |
| O4 | P | O5 | C4 | 173.0° | 55.1° |
| O4 | P | O1 | H26 | 0.0° | 180.0° |
| P | O5 | C4 | C5 | 161.1° | 180.0° |
| O5 | P | O1 | H26 | 108.2° | 60.0° |
| P | O5 | C4 | H27 | 79.4° | 60.0° |
| P | O5 | C4 | H28 | 41.6° | 60.0° |
| C4 | O5 | P | O1 | 40.6° | 65.0° |
| O5 | C4 | C5 | H27 | 119.5° | 119.9° |
| O5 | C4 | C5 | H28 | 119.5° | 120.0° |
| O5 | C4 | C5 | N1 | 152.6° | 66.5° |
| O5 | C4 | H27 | H28 | 121.5° | 120.0° |
| O5 | C4 | C5 | H29 | 86.8° | 173.5° |
| O5 | C4 | C5 | H30 | 32.1° | 53.5° |
| C4 | C5 | N1 | C8 | 174.9° | 54.4° |
| C4 | C5 | N1 | H29 | 120.6° | 120.0° |
| C4 | C5 | N1 | H30 | 120.5° | 120.0° |
| C4 | C5 | N1 | C7 | 66.0° | 65.5° |
| C5 | C4 | H27 | H28 | 121.5° | 120.0° |
| C4 | C5 | H29 | H30 | 118.3° | 119.9° |
| C8 | N1 | C5 | C7 | 119.1° | 120.0° |
| C8 | N1 | C5 | H29 | 64.5° | 65.6° |
| C8 | N1 | C5 | H30 | 54.4° | 174.4° |
| C8 | N1 | C6 | H31 | 180.0° | 60.0° |
| C8 | N1 | C6 | H32 | 60.0° | 179.9° |
| C8 | N1 | C6 | H33 | 60.0° | 60.0° |
| C8 | N1 | C7 | H34 | 62.0° | 71.1° |
| C8 | N1 | C7 | H35 | 58.0° | 168.9° |
| C8 | N1 | C7 | H36 | 178.0° | 48.9° |
| N1 | C8 | H37 | H38 | 120.0° | 120.0° |
| N1 | C8 | H37 | H39 | 120.0° | 120.0° |
| N1 | C8 | H38 | H39 | 119.9° | 120.0° |
| N1 | C5 | C4 | H27 | 33.1° | 53.5° |
| N1 | C5 | C4 | H28 | 87.9° | 173.5° |
| N1 | C5 | H29 | H30 | 118.2° | 120.0° |
| C5 | N1 | C6 | H31 | 57.2° | 60.0° |
| C5 | N1 | C6 | H32 | 177.2° | 60.0° |
| C5 | N1 | C6 | H33 | 62.8° | 180.0° |
| C5 | N1 | C7 | H34 | 59.1° | 169.0° |
| C5 | N1 | C7 | H35 | 179.2° | 49.0° |
| C5 | N1 | C7 | H36 | 60.8° | 71.0° |
| C5 | N1 | C8 | H37 | 57.4° | 60.0° |
| C5 | N1 | C8 | H38 | 62.6° | 180.0° |
| C5 | N1 | C8 | H39 | 177.4° | 60.0° |
| C7 | N1 | C5 | H29 | 54.6° | 174.5° |
| C7 | N1 | C5 | H30 | 173.4° | 54.4° |
| C7 | N1 | C6 | H31 | 63.2° | 180.0° |
| C7 | N1 | C6 | H32 | 56.8° | 60.0° |
| C7 | N1 | C6 | H33 | 176.8° | 60.0° |
| N1 | C7 | H34 | H35 | 120.0° | 120.0° |
| N1 | C7 | H34 | H36 | 120.0° | 120.0° |
| N1 | C7 | H35 | H36 | 120.0° | 120.0° |
| C7 | N1 | C8 | H37 | 63.1° | 180.0° |
| C7 | N1 | C8 | H38 | 176.9° | 60.0° |
| C7 | N1 | C8 | H39 | 56.9° | 59.9° |
| H1 | C3 | H2 | H3 | 120.0° | 120.0° |
| H1 | C3 | C2 | H4 | 57.1° | 180.0° |
| H2 | C3 | C2 | H4 | 62.9° | 60.0° |
| H3 | C3 | C2 | H4 | 177.1° | 60.0° |
| H4 | C2 | C1 | H5 | 59.1° | 64.9° |
| H4 | C2 | C1 | H6 | 61.1° | 55.0° |
| H7 | C32 | C33 | H9 | 161.5° | 179.9° |
| H7 | C32 | C33 | H10 | 80.3° | 60.0° |
| H8 | C32 | C33 | H9 | 43.0° | 60.0° |
| H8 | C32 | C33 | H10 | 161.1° | 180.0° |
| H9 | C33 | C34 | H11 | 135.2° | 180.0° |
| H9 | C33 | C34 | H12 | 16.8° | 60.0° |
| H10 | C33 | C34 | H11 | 106.7° | 60.0° |
| H10 | C33 | C34 | H12 | 134.9° | 180.0° |
| H11 | C34 | C35 | H13 | 151.7° | 180.0° |
| H11 | C34 | C35 | H14 | 90.0° | 60.1° |
| H12 | C34 | C35 | H13 | 33.3° | 60.1° |
| H12 | C34 | C35 | H14 | 151.6° | 180.0° |
| H13 | C35 | C36 | H15 | 139.2° | 180.0° |
| H13 | C35 | C36 | H16 | 20.8° | 60.1° |
| H14 | C35 | C36 | H15 | 102.5° | 60.0° |
| H14 | C35 | C36 | H16 | 139.1° | 179.9° |
| H15 | C36 | C37 | H17 | 148.6° | 180.0° |
| H15 | C36 | C37 | H18 | 92.8° | 60.0° |
| H16 | C36 | C37 | H17 | 30.2° | 60.1° |
| H16 | C36 | C37 | H18 | 148.8° | 179.9° |
| H17 | C37 | C38 | H19 | 144.6° | 180.0° |
| H17 | C37 | C38 | H20 | 25.5° | 60.0° |
| H18 | C37 | C38 | H19 | 96.8° | 60.0° |
| H18 | C37 | C38 | H20 | 144.1° | 180.0° |
| H19 | C38 | C39 | H21 | 159.9° | 179.9° |
| H19 | C38 | C39 | H22 | 81.3° | 59.9° |
| H20 | C38 | C39 | H21 | 40.8° | 60.0° |
| H20 | C38 | C39 | H22 | 159.6° | 180.0° |
| H21 | C39 | C40 | H23 | 59.4° | 179.9° |
| H21 | C39 | C40 | H24 | 60.6° | 60.0° |
| H21 | C39 | C40 | H25 | 179.4° | 60.0° |
| H22 | C39 | C40 | H23 | 59.4° | 59.9° |
| H22 | C39 | C40 | H24 | 179.4° | 180.0° |
| H22 | C39 | C40 | H25 | 60.6° | 60.0° |
| H23 | C40 | H24 | H25 | 120.0° | 120.0° |
| H27 | C4 | C5 | H29 | 153.7° | 66.6° |
| H27 | C4 | C5 | H30 | 87.4° | 173.5° |
| H28 | C4 | C5 | H29 | 32.7° | 53.5° |
| H28 | C4 | C5 | H30 | 151.6° | 66.5° |
| H31 | C6 | H32 | H33 | 120.0° | 120.0° |
| H34 | C7 | H35 | H36 | 120.0° | 120.0° |
| H37 | C8 | H38 | H39 | 120.0° | 119.9° |
