SVP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N35 | C36 | sing | 1.45Å | 1.46Å | |
| N35 | C33 | sing | 1.35Å | 1.35Å | |
| C37 | C36 | sing | 1.53Å | 1.54Å | |
| C37 | S38 | sing | 1.79Å | 1.82Å | |
| O34 | C33 | doub | 1.24Å | 1.21Å | |
| C36 | C31 | sing | 1.55Å | 1.55Å | |
| C33 | N32 | sing | 1.35Å | 1.34Å | |
| S38 | C01 | sing | 1.82Å | 1.81Å | |
| N32 | C31 | sing | 1.45Å | 1.46Å | |
| C31 | C01 | sing | 1.57Å | 1.55Å | |
| C01 | C02 | sing | 1.53Å | 1.55Å | |
| C02 | C03 | sing | 1.53Å | 1.56Å | |
| C03 | C04 | sing | 1.54Å | 1.54Å | |
| C04 | C05 | sing | 1.53Å | 1.54Å | |
| C05 | C06 | sing | 1.52Å | 1.51Å | |
| C29 | C27 | sing | 1.55Å | 1.55Å | |
| C28 | C27 | sing | 1.55Å | 1.55Å | |
| C06 | N08 | sing | 1.35Å | 1.35Å | |
| C06 | O07 | doub | 1.24Å | 1.21Å | |
| N08 | C09 | sing | 1.47Å | 1.47Å | |
| C10 | C09 | sing | 1.51Å | 1.54Å | |
| C10 | P11 | sing | 1.88Å | 1.83Å | |
| C27 | C30 | sing | 1.55Å | 1.55Å | |
| C27 | P11 | sing | 1.93Å | 1.86Å | |
| P11 | C23 | sing | 1.93Å | 1.87Å | |
| P11 | PD | sing | 2.33Å | 2.32Å | |
| C25 | C23 | sing | 1.55Å | 1.55Å | |
| C23 | C26 | sing | 1.55Å | 1.54Å | |
| C23 | C24 | sing | 1.55Å | 1.55Å | |
| PD | CL | sing | 2.38Å | 2.37Å | |
| C01 | H1 | sing | 1.00Å | 1.10Å | |
| C02 | H2 | sing | 0.98Å | 1.10Å | |
| C02 | H3 | sing | 0.98Å | 1.10Å | |
| C03 | H4 | sing | 0.98Å | 1.10Å | |
| C03 | H5 | sing | 0.98Å | 1.10Å | |
| C04 | H6 | sing | 0.98Å | 1.10Å | |
| C04 | H7 | sing | 0.98Å | 1.10Å | |
| C05 | H8 | sing | 0.98Å | 1.10Å | |
| C05 | H9 | sing | 0.98Å | 1.10Å | |
| N08 | H10 | sing | 0.88Å | 1.00Å | |
| C09 | H11 | sing | 0.99Å | 1.10Å | |
| C09 | H12 | sing | 0.98Å | 1.10Å | |
| C10 | H13 | sing | 0.98Å | 1.10Å | |
| C10 | H14 | sing | 0.98Å | 1.10Å | |
| C24 | H15 | sing | 0.98Å | 1.10Å | |
| C24 | H16 | sing | 0.97Å | 1.10Å | |
| C24 | H17 | sing | 0.98Å | 1.10Å | |
| C25 | H18 | sing | 0.98Å | 1.10Å | |
| C25 | H19 | sing | 0.98Å | 1.10Å | |
| C25 | H20 | sing | 0.97Å | 1.10Å | |
| C26 | H21 | sing | 0.97Å | 1.10Å | |
| C26 | H22 | sing | 0.98Å | 1.10Å | |
| C26 | H23 | sing | 0.98Å | 1.10Å | |
| C28 | H24 | sing | 0.97Å | 1.10Å | |
| C28 | H25 | sing | 0.98Å | 1.10Å | |
| C28 | H26 | sing | 0.97Å | 1.10Å | |
| C29 | H27 | sing | 0.97Å | 1.10Å | |
| C29 | H28 | sing | 0.98Å | 1.10Å | |
| C29 | H29 | sing | 0.98Å | 1.10Å | |
| C30 | H30 | sing | 0.97Å | 1.10Å | |
| C30 | H31 | sing | 0.98Å | 1.10Å | |
| C30 | H32 | sing | 0.97Å | 1.10Å | |
| C31 | H33 | sing | 0.99Å | 1.10Å | |
| N32 | H34 | sing | 0.86Å | 1.00Å | |
| N35 | H35 | sing | 0.86Å | 1.00Å | |
| C36 | H36 | sing | 0.99Å | 1.10Å | |
| C37 | H37 | sing | 0.99Å | 1.10Å | |
| C37 | H38 | sing | 0.99Å | 1.10Å | |
| C1 | C2 | sing | 1.47Å | 0.00Å | |
| C2 | C3 | doub | 1.54Å | 0.00Å | |
| C3 | C4 | sing | 1.48Å | 0.00Å | |
| C4 | C5 | doub | 1.40Å | 0.00Å | Aromatic |
| C4 | C6 | sing | 1.40Å | 0.00Å | Aromatic |
| C6 | C11 | doub | 1.38Å | 0.00Å | Aromatic |
| C5 | C8 | sing | 1.39Å | 0.00Å | Aromatic |
| C8 | C9 | doub | 1.37Å | 0.00Å | Aromatic |
| C9 | C11 | sing | 1.38Å | 0.00Å | Aromatic |
| PD | C1 | sing | 1.76Å | 41.15Å | |
| PD | C3 | sing | 1.79Å | 41.15Å | |
| C1 | H39 | sing | 0.95Å | 0.00Å | |
| C1 | H40 | sing | 0.95Å | 0.00Å | |
| C2 | H41 | sing | 0.94Å | 0.00Å | |
| C5 | H42 | sing | 0.94Å | 0.00Å | |
| C6 | H43 | sing | 0.94Å | 0.00Å | |
| C8 | H44 | sing | 0.94Å | 0.00Å | |
| C9 | H45 | sing | 0.94Å | 0.00Å | |
| C11 | H46 | sing | 0.94Å | 0.00Å | |
| PD | C2 | sing | 1.76Å | 41.15Å | |
| H47 | C3 | sing | 0.95Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C36 | N35 | C33 | 113.4° | 113.4° |
| N35 | C36 | C37 | 110.7° | 113.0° |
| N35 | C36 | C31 | 102.5° | 102.6° |
| C36 | N35 | H35 | 123.3° | 124.4° |
| N35 | C36 | H36 | 112.7° | 110.1° |
| N35 | C33 | O34 | 126.6° | 126.0° |
| N35 | C33 | N32 | 107.9° | 108.0° |
| C33 | N35 | H35 | 123.3° | 122.2° |
| C36 | C37 | S38 | 107.8° | 106.2° |
| C37 | C36 | C31 | 107.8° | 109.5° |
| C37 | C36 | H36 | 111.4° | 110.6° |
| C36 | C37 | H37 | 109.9° | 110.5° |
| C36 | C37 | H38 | 109.9° | 110.5° |
| C37 | S38 | C01 | 87.4° | 90.4° |
| S38 | C37 | H37 | 109.9° | 110.5° |
| S38 | C37 | H38 | 109.9° | 110.5° |
| O34 | C33 | N32 | 125.5° | 126.0° |
| C36 | C31 | N32 | 102.3° | 102.2° |
| C36 | C31 | C01 | 108.5° | 108.2° |
| C36 | C31 | H33 | 110.9° | 110.1° |
| C31 | C36 | H36 | 111.4° | 110.7° |
| C33 | N32 | C31 | 113.8° | 113.7° |
| C33 | N32 | H34 | 123.1° | 121.7° |
| S38 | C01 | C31 | 106.9° | 102.9° |
| S38 | C01 | C02 | 111.6° | 110.4° |
| S38 | C01 | H1 | 105.8° | 107.5° |
| N32 | C31 | C01 | 111.8° | 116.3° |
| N32 | C31 | H33 | 112.1° | 109.6° |
| C31 | N32 | H34 | 123.1° | 124.6° |
| C31 | C01 | C02 | 114.8° | 120.4° |
| C31 | C01 | H1 | 108.7° | 107.6° |
| C01 | C31 | H33 | 110.9° | 110.1° |
| C01 | C02 | C03 | 110.4° | 117.2° |
| C02 | C01 | H1 | 108.6° | 107.4° |
| C01 | C02 | H2 | 109.2° | 108.2° |
| C01 | C02 | H3 | 109.2° | 108.0° |
| C02 | C03 | C04 | 112.5° | 115.7° |
| C03 | C02 | H2 | 109.3° | 108.0° |
| C03 | C02 | H3 | 109.2° | 108.1° |
| C02 | C03 | H4 | 108.7° | 108.8° |
| C02 | C03 | H5 | 108.7° | 108.6° |
| C03 | C04 | C05 | 111.2° | 116.2° |
| C04 | C03 | H4 | 108.7° | 108.7° |
| C04 | C03 | H5 | 108.7° | 108.1° |
| C03 | C04 | H6 | 109.0° | 107.8° |
| C03 | C04 | H7 | 109.1° | 108.9° |
| C04 | C05 | C06 | 113.9° | 113.7° |
| C05 | C04 | H6 | 109.1° | 108.3° |
| C05 | C04 | H7 | 109.0° | 108.5° |
| C04 | C05 | H8 | 108.4° | 109.2° |
| C04 | C05 | H9 | 108.4° | 108.6° |
| C05 | C06 | N08 | 114.8° | 117.9° |
| C05 | C06 | O07 | 123.5° | 120.0° |
| C06 | C05 | H8 | 108.4° | 109.2° |
| C06 | C05 | H9 | 108.4° | 108.5° |
| C29 | C27 | C28 | 105.8° | 108.1° |
| C29 | C27 | C30 | 106.5° | 106.1° |
| C29 | C27 | P11 | 113.3° | 112.9° |
| C27 | C29 | H27 | 109.5° | 110.3° |
| C27 | C29 | H28 | 109.4° | 110.8° |
| C27 | C29 | H29 | 109.5° | 109.3° |
| C28 | C27 | C30 | 109.0° | 109.2° |
| C28 | C27 | P11 | 109.0° | 110.2° |
| C27 | C28 | H24 | 109.5° | 110.2° |
| C27 | C28 | H25 | 109.5° | 110.6° |
| C27 | C28 | H26 | 109.5° | 109.4° |
| N08 | C06 | O07 | 121.7° | 122.1° |
| C06 | N08 | C09 | 122.7° | 127.0° |
| C06 | N08 | H10 | 118.7° | 117.4° |
| N08 | C09 | C10 | 111.5° | 116.3° |
| C09 | N08 | H10 | 118.6° | 115.6° |
| N08 | C09 | H11 | 109.0° | 107.6° |
| N08 | C09 | H12 | 108.9° | 108.8° |
| C09 | C10 | P11 | 117.3° | 124.2° |
| C10 | C09 | H11 | 109.0° | 108.0° |
| C10 | C09 | H12 | 109.0° | 108.9° |
| C09 | C10 | H13 | 107.5° | 107.4° |
| C09 | C10 | H14 | 107.5° | 107.8° |
| C10 | P11 | C27 | 107.1° | 114.1° |
| C10 | P11 | C23 | 110.9° | 107.2° |
| C10 | P11 | PD | 110.9° | 97.0° |
| P11 | C10 | H13 | 107.5° | 104.9° |
| P11 | C10 | H14 | 107.5° | 105.0° |
| C30 | C27 | P11 | 112.9° | 110.1° |
| C27 | C30 | H30 | 109.5° | 109.6° |
| C27 | C30 | H31 | 109.4° | 110.4° |
| C27 | C30 | H32 | 109.5° | 110.4° |
| C27 | P11 | C23 | 116.2° | 118.9° |
| C27 | P11 | PD | 113.7° | 110.6° |
| C23 | P11 | PD | 97.8° | 106.5° |
| P11 | C23 | C25 | 115.5° | 112.1° |
| P11 | C23 | C26 | 113.3° | 107.8° |
| P11 | C23 | C24 | 109.8° | 113.7° |
| P11 | PD | CL | 107.9° | 129.8° |
| P11 | PD | C1 | 60.5° | 121.6° |
| P11 | PD | C3 | 60.5° | 117.2° |
| P11 | PD | C2 | 60.5° | 146.8° |
| C25 | C23 | C26 | 106.7° | 109.5° |
| C25 | C23 | C24 | 104.6° | 106.5° |
| C23 | C25 | H18 | 109.5° | 110.6° |
| C23 | C25 | H19 | 109.5° | 109.4° |
| C23 | C25 | H20 | 109.5° | 110.4° |
| C26 | C23 | C24 | 106.2° | 107.2° |
| C23 | C26 | H21 | 109.5° | 110.1° |
| C23 | C26 | H22 | 109.4° | 109.5° |
| C23 | C26 | H23 | 109.5° | 110.6° |
| C23 | C24 | H15 | 109.5° | 110.6° |
| C23 | C24 | H16 | 109.4° | 109.5° |
| C23 | C24 | H17 | 109.4° | 110.3° |
| CL | PD | C1 | 146.4° | 53.7° |
| CL | PD | C3 | 146.4° | 112.3° |
| CL | PD | C2 | 146.4° | 74.5° |
| H2 | C02 | H3 | 109.5° | 106.9° |
| H4 | C03 | H5 | 109.4° | 106.6° |
| H6 | C04 | H7 | 109.5° | 106.8° |
| H8 | C05 | H9 | 109.4° | 107.5° |
| H11 | C09 | H12 | 109.5° | 106.7° |
| H13 | C10 | H14 | 109.5° | 106.4° |
| H15 | C24 | H16 | 109.5° | 108.9° |
| H15 | C24 | H17 | 109.5° | 108.7° |
| H16 | C24 | H17 | 109.5° | 108.8° |
| H18 | C25 | H19 | 109.5° | 109.0° |
| H18 | C25 | H20 | 109.4° | 108.7° |
| H19 | C25 | H20 | 109.5° | 108.7° |
| H21 | C26 | H22 | 109.5° | 108.8° |
| H21 | C26 | H23 | 109.5° | 108.8° |
| H22 | C26 | H23 | 109.5° | 109.0° |
| H24 | C28 | H25 | 109.5° | 108.9° |
| H24 | C28 | H26 | 109.4° | 108.8° |
| H25 | C28 | H26 | 109.5° | 109.0° |
| H27 | C29 | H28 | 109.5° | 108.8° |
| H27 | C29 | H29 | 109.5° | 108.7° |
| H28 | C29 | H29 | 109.5° | 109.0° |
| H30 | C30 | H31 | 109.5° | 108.9° |
| H30 | C30 | H32 | 109.5° | 108.7° |
| H31 | C30 | H32 | 109.5° | 108.8° |
| H37 | C37 | H38 | 109.5° | 108.6° |
| C1 | C2 | C3 | 90.0° | 129.7° |
| C2 | C1 | PD | 90.0° | 65.1° |
| C2 | C1 | H39 | 90.0° | 109.3° |
| C2 | C1 | H40 | 90.0° | 108.1° |
| C1 | C2 | H41 | 90.0° | 112.9° |
| C1 | C2 | PD | 90.0° | 65.7° |
| C2 | C3 | C4 | 90.0° | 128.3° |
| C2 | C3 | PD | 90.0° | 63.3° |
| C3 | C2 | H41 | 90.0° | 117.3° |
| C3 | C2 | PD | 90.0° | 65.3° |
| C2 | C3 | H47 | 90.0° | 116.2° |
| C3 | C4 | C5 | 90.0° | 123.4° |
| C3 | C4 | C6 | 90.0° | 119.3° |
| C4 | C3 | PD | 90.0° | 168.4° |
| C4 | C3 | H47 | 90.0° | 115.5° |
| C5 | C4 | C6 | 90.0° | 117.2° |
| C4 | C5 | C8 | 90.0° | 121.2° |
| C4 | C5 | H42 | 90.0° | 119.5° |
| C4 | C6 | C11 | 90.0° | 121.3° |
| C4 | C6 | H43 | 90.0° | 119.2° |
| C6 | C11 | C9 | 90.0° | 120.2° |
| C11 | C6 | H43 | 90.0° | 119.4° |
| C6 | C11 | H46 | 90.0° | 119.9° |
| C5 | C8 | C9 | 90.0° | 120.3° |
| C8 | C5 | H42 | 90.0° | 119.3° |
| C5 | C8 | H44 | 90.0° | 119.8° |
| C8 | C9 | C11 | 90.0° | 119.7° |
| C9 | C8 | H44 | 90.0° | 119.8° |
| C8 | C9 | H45 | 90.0° | 120.2° |
| C11 | C9 | H45 | 90.0° | 120.1° |
| C9 | C11 | H46 | 90.0° | 119.9° |
| C1 | PD | C3 | 0.0° | 99.9° |
| PD | C1 | H39 | 90.0° | 66.4° |
| PD | C1 | H40 | 90.0° | 166.7° |
| C1 | PD | C2 | 0.0° | 49.2° |
| C3 | PD | C2 | 0.0° | 51.4° |
| PD | C3 | H47 | 90.0° | 53.0° |
| H39 | C1 | H40 | 90.0° | 107.6° |
| H41 | C2 | PD | 90.0° | 167.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C36 | N35 | C33 | H35 | 180.0° | 179.9° |
| N35 | C36 | C37 | C31 | 111.3° | 113.8° |
| N35 | C36 | C37 | H36 | 126.2° | 124.0° |
| N35 | C36 | C37 | S38 | 83.0° | 87.6° |
| C36 | N35 | C33 | O34 | 179.4° | 178.7° |
| N35 | C36 | C31 | H36 | 120.7° | 117.5° |
| C36 | N35 | C33 | N32 | 1.8° | 1.5° |
| N35 | C36 | C31 | N32 | 0.9° | 2.9° |
| N35 | C36 | C31 | C01 | 119.2° | 126.1° |
| N35 | C36 | C31 | H33 | 118.8° | 113.5° |
| N35 | C36 | C37 | H37 | 157.2° | 32.3° |
| N35 | C36 | C37 | H38 | 36.7° | 152.6° |
| C33 | N35 | C36 | C37 | 113.0° | 115.0° |
| N35 | C33 | O34 | N32 | 178.6° | 179.8° |
| C33 | N35 | C36 | C31 | 1.7° | 2.8° |
| N35 | C33 | N32 | C31 | 1.1° | 0.6° |
| N35 | C33 | N32 | H34 | 178.9° | 179.8° |
| C33 | N35 | C36 | H36 | 121.5° | 120.7° |
| C36 | C37 | S38 | H37 | 119.8° | 119.9° |
| C36 | C37 | S38 | H38 | 119.8° | 119.8° |
| C37 | C36 | C31 | H36 | 122.5° | 122.2° |
| C36 | C37 | S38 | C01 | 40.9° | 41.4° |
| C37 | C36 | C31 | N32 | 115.9° | 117.5° |
| C37 | C36 | C31 | C01 | 2.4° | 5.7° |
| C37 | C36 | C31 | H33 | 124.4° | 126.1° |
| C37 | C36 | N35 | H35 | 67.0° | 64.9° |
| C36 | C37 | H37 | H38 | 120.8° | 121.3° |
| S38 | C37 | C36 | C31 | 28.3° | 26.2° |
| C37 | S38 | C01 | C31 | 42.0° | 43.6° |
| C37 | S38 | C01 | C02 | 168.3° | 173.4° |
| C37 | S38 | C01 | H1 | 73.8° | 69.8° |
| S38 | C37 | C36 | H36 | 150.8° | 148.4° |
| S38 | C37 | H37 | H38 | 120.7° | 121.4° |
| O34 | C33 | N32 | C31 | 179.9° | 179.2° |
| O34 | C33 | N32 | H34 | 0.1° | 0.0° |
| O34 | C33 | N35 | H35 | 0.6° | 1.3° |
| C36 | C31 | N32 | C33 | 0.1° | 2.3° |
| C36 | C31 | C01 | S38 | 32.2° | 34.1° |
| C36 | C31 | N32 | C01 | 115.9° | 117.5° |
| C36 | C31 | N32 | H33 | 118.8° | 116.8° |
| C36 | C31 | C01 | H33 | 121.9° | 120.4° |
| C36 | C31 | C01 | C02 | 156.6° | 157.4° |
| C36 | C31 | C01 | H1 | 81.6° | 79.2° |
| C36 | C31 | N32 | H34 | 179.9° | 178.6° |
| C31 | C36 | N35 | H35 | 178.3° | 177.2° |
| C31 | C36 | C37 | H37 | 91.4° | 146.1° |
| C31 | C36 | C37 | H38 | 148.1° | 93.7° |
| C33 | N32 | C31 | H34 | 180.0° | 179.1° |
| C33 | N32 | C31 | C01 | 115.8° | 119.8° |
| C33 | N32 | C31 | H33 | 118.9° | 114.5° |
| N32 | C33 | N35 | H35 | 178.2° | 178.5° |
| S38 | C01 | C31 | N32 | 79.9° | 80.0° |
| S38 | C01 | C31 | C02 | 124.4° | 123.3° |
| S38 | C01 | C31 | H1 | 113.8° | 113.3° |
| S38 | C01 | C02 | H1 | 116.3° | 116.9° |
| S38 | C01 | C02 | C03 | 77.2° | 165.8° |
| S38 | C01 | C02 | H2 | 43.0° | 71.9° |
| S38 | C01 | C02 | H3 | 162.7° | 43.5° |
| S38 | C01 | C31 | H33 | 154.1° | 154.6° |
| C01 | S38 | C37 | H37 | 78.8° | 161.3° |
| C01 | S38 | C37 | H38 | 160.7° | 78.4° |
| N32 | C31 | C01 | H33 | 125.9° | 125.4° |
| N32 | C31 | C01 | C02 | 44.4° | 43.3° |
| N32 | C31 | C01 | H1 | 166.3° | 166.7° |
| N32 | C31 | C36 | H36 | 121.6° | 120.4° |
| C31 | C01 | C02 | H1 | 121.9° | 123.5° |
| C31 | C01 | C02 | C03 | 161.0° | 74.6° |
| C31 | C01 | C02 | H2 | 78.8° | 47.7° |
| C31 | C01 | C02 | H3 | 40.9° | 163.1° |
| C01 | C31 | N32 | H34 | 64.2° | 61.1° |
| C01 | C31 | C36 | H36 | 120.1° | 116.5° |
| C01 | C02 | C03 | H2 | 120.1° | 122.4° |
| C01 | C02 | C03 | H3 | 120.1° | 122.2° |
| C01 | C02 | C03 | C04 | 171.1° | 174.4° |
| C01 | C02 | H2 | H3 | 119.6° | 116.1° |
| C01 | C02 | C03 | H4 | 68.5° | 51.7° |
| C01 | C02 | C03 | H5 | 50.6° | 64.0° |
| C02 | C01 | C31 | H33 | 81.5° | 82.2° |
| C02 | C03 | C04 | H4 | 120.5° | 122.7° |
| C02 | C03 | C04 | H5 | 120.4° | 121.9° |
| C02 | C03 | C04 | C05 | 179.0° | 98.2° |
| C03 | C02 | C01 | H1 | 39.1° | 48.9° |
| C03 | C02 | H2 | H3 | 119.6° | 116.2° |
| C02 | C03 | H4 | H5 | 118.6° | 116.9° |
| C02 | C03 | C04 | H6 | 58.7° | 140.1° |
| C02 | C03 | C04 | H7 | 60.8° | 24.6° |
| C03 | C04 | C05 | H6 | 120.3° | 121.4° |
| C03 | C04 | C05 | H7 | 120.3° | 123.1° |
| C03 | C04 | C05 | C06 | 75.3° | 169.1° |
| C04 | C03 | C02 | H2 | 50.9° | 63.2° |
| C04 | C03 | C02 | H3 | 68.8° | 52.2° |
| C04 | C03 | H4 | H5 | 118.7° | 116.3° |
| C03 | C04 | H6 | H7 | 119.2° | 116.9° |
| C03 | C04 | C05 | H8 | 45.3° | 47.0° |
| C03 | C04 | C05 | H9 | 164.0° | 70.0° |
| C04 | C05 | C06 | H8 | 120.7° | 122.1° |
| C04 | C05 | C06 | H9 | 120.7° | 120.9° |
| C04 | C05 | C06 | N08 | 152.8° | 101.2° |
| C04 | C05 | C06 | O07 | 27.6° | 78.2° |
| C05 | C04 | C03 | H4 | 60.6° | 24.5° |
| C05 | C04 | C03 | H5 | 58.5° | 139.9° |
| C05 | C04 | H6 | H7 | 119.2° | 116.6° |
| C04 | C05 | H8 | H9 | 118.0° | 117.6° |
| C05 | C06 | N08 | O07 | 179.6° | 179.4° |
| C05 | C06 | N08 | C09 | 179.7° | 166.5° |
| C06 | C05 | C04 | H6 | 164.4° | 69.5° |
| C06 | C05 | C04 | H7 | 44.9° | 46.0° |
| C06 | C05 | H8 | H9 | 118.0° | 117.6° |
| C05 | C06 | N08 | H10 | 0.3° | 13.4° |
| C29 | C27 | C28 | C30 | 114.1° | 115.0° |
| C29 | C27 | C28 | P11 | 122.2° | 123.9° |
| C29 | C27 | P11 | C10 | 61.7° | 165.3° |
| C29 | C27 | C30 | P11 | 124.9° | 122.5° |
| C29 | C27 | P11 | C23 | 173.7° | 37.1° |
| C29 | C27 | P11 | PD | 61.2° | 86.6° |
| C29 | C27 | C28 | H24 | 180.0° | 174.1° |
| C29 | C27 | C28 | H25 | 60.0° | 53.7° |
| C29 | C27 | C28 | H26 | 60.0° | 66.3° |
| C27 | C29 | H27 | H28 | 120.0° | 121.7° |
| C27 | C29 | H27 | H29 | 120.0° | 119.8° |
| C27 | C29 | H28 | H29 | 120.0° | 120.3° |
| C29 | C27 | C30 | H30 | 180.0° | 61.8° |
| C29 | C27 | C30 | H31 | 60.0° | 58.1° |
| C29 | C27 | C30 | H32 | 60.0° | 178.4° |
| C28 | C27 | P11 | C10 | 55.9° | 44.2° |
| C28 | C27 | C30 | P11 | 121.3° | 121.2° |
| C28 | C27 | P11 | C23 | 68.7° | 83.9° |
| C28 | C27 | P11 | PD | 178.8° | 152.3° |
| C27 | C28 | H24 | H25 | 120.0° | 121.4° |
| C27 | C28 | H24 | H26 | 120.0° | 120.0° |
| C27 | C28 | H25 | H26 | 120.0° | 120.3° |
| C28 | C27 | C29 | H27 | 180.0° | 56.2° |
| C28 | C27 | C29 | H28 | 60.0° | 64.3° |
| C28 | C27 | C29 | H29 | 60.0° | 175.7° |
| C28 | C27 | C30 | H30 | 66.3° | 178.2° |
| C28 | C27 | C30 | H31 | 53.7° | 58.2° |
| C28 | C27 | C30 | H32 | 173.7° | 62.1° |
| C06 | N08 | C09 | H10 | 180.0° | 179.9° |
| C06 | N08 | C09 | C10 | 66.2° | 141.5° |
| N08 | C06 | C05 | H8 | 32.2° | 20.9° |
| N08 | C06 | C05 | H9 | 86.5° | 137.9° |
| C06 | N08 | C09 | H11 | 173.5° | 97.2° |
| C06 | N08 | C09 | H12 | 54.1° | 18.0° |
| O07 | C06 | N08 | C09 | 0.1° | 14.1° |
| O07 | C06 | C05 | H8 | 148.3° | 159.6° |
| O07 | C06 | C05 | H9 | 93.1° | 42.7° |
| O07 | C06 | N08 | H10 | 179.9° | 166.0° |
| N08 | C09 | C10 | H11 | 120.3° | 121.1° |
| N08 | C09 | C10 | H12 | 120.3° | 123.4° |
| N08 | C09 | C10 | P11 | 174.8° | 104.9° |
| N08 | C09 | H11 | H12 | 119.1° | 116.6° |
| N08 | C09 | C10 | H13 | 53.7° | 17.7° |
| N08 | C09 | C10 | H14 | 64.1° | 132.0° |
| C09 | C10 | P11 | H13 | 121.1° | 123.7° |
| C09 | C10 | P11 | H14 | 121.1° | 124.3° |
| C09 | C10 | P11 | C27 | 146.1° | 39.2° |
| C09 | C10 | P11 | C23 | 86.1° | 173.1° |
| C09 | C10 | P11 | PD | 21.5° | 77.1° |
| C10 | C09 | N08 | H10 | 113.8° | 38.6° |
| C10 | C09 | H11 | H12 | 119.1° | 117.0° |
| C09 | C10 | H13 | H14 | 116.4° | 115.2° |
| C10 | P11 | C27 | C30 | 177.2° | 76.3° |
| C10 | P11 | C27 | C23 | 124.7° | 128.1° |
| C10 | P11 | C27 | PD | 122.9° | 108.1° |
| C10 | P11 | C23 | PD | 116.0° | 103.0° |
| C10 | P11 | C23 | C25 | 89.7° | 89.0° |
| C10 | P11 | C23 | C26 | 33.9° | 150.4° |
| C10 | P11 | C23 | C24 | 152.4° | 31.8° |
| C10 | P11 | PD | CL | 75.1° | 98.2° |
| P11 | C10 | C09 | H11 | 64.9° | 134.0° |
| P11 | C10 | C09 | H12 | 54.5° | 18.5° |
| P11 | C10 | H13 | H14 | 116.5° | 110.9° |
| C10 | P11 | PD | C1 | 70.3° | 165.2° |
| C10 | P11 | PD | C3 | 70.3° | 71.8° |
| C10 | P11 | PD | C2 | 70.3° | 132.2° |
| C30 | C27 | P11 | C23 | 52.5° | 155.5° |
| C30 | C27 | P11 | PD | 59.9° | 31.8° |
| C30 | C27 | C28 | H24 | 65.8° | 59.0° |
| C30 | C27 | C28 | H25 | 174.1° | 61.3° |
| C30 | C27 | C28 | H26 | 54.1° | 178.6° |
| C30 | C27 | C29 | H27 | 64.1° | 173.3° |
| C30 | C27 | C29 | H28 | 55.9° | 52.8° |
| C30 | C27 | C29 | H29 | 175.9° | 67.3° |
| C27 | C30 | H30 | H31 | 120.0° | 120.8° |
| C27 | C30 | H30 | H32 | 120.0° | 120.8° |
| C27 | C30 | H31 | H32 | 120.0° | 121.3° |
| C27 | P11 | C23 | PD | 121.3° | 125.7° |
| C27 | P11 | C23 | C25 | 33.0° | 42.3° |
| C27 | P11 | C23 | C26 | 156.6° | 78.2° |
| C27 | P11 | C23 | C24 | 84.9° | 163.1° |
| C27 | P11 | PD | CL | 164.1° | 20.9° |
| C27 | P11 | C10 | H13 | 92.8° | 162.9° |
| C27 | P11 | C10 | H14 | 25.0° | 85.1° |
| P11 | C27 | C28 | H24 | 57.8° | 62.1° |
| P11 | C27 | C28 | H25 | 62.2° | 177.6° |
| P11 | C27 | C28 | H26 | 177.8° | 57.6° |
| P11 | C27 | C29 | H27 | 60.6° | 66.0° |
| P11 | C27 | C29 | H28 | 179.4° | 173.5° |
| P11 | C27 | C29 | H29 | 59.4° | 53.4° |
| P11 | C27 | C30 | H30 | 55.0° | 60.7° |
| P11 | C27 | C30 | H31 | 175.0° | 179.4° |
| P11 | C27 | C30 | H32 | 64.9° | 59.1° |
| C27 | P11 | PD | C1 | 50.5° | 46.1° |
| C27 | P11 | PD | C3 | 50.5° | 169.1° |
| C27 | P11 | PD | C2 | 50.5° | 108.7° |
| P11 | C23 | C25 | C26 | 126.9° | 119.5° |
| P11 | C23 | C25 | C24 | 120.8° | 124.9° |
| P11 | C23 | C26 | C24 | 120.6° | 122.7° |
| C23 | P11 | PD | CL | 40.9° | 151.5° |
| C23 | P11 | C10 | H13 | 35.0° | 63.1° |
| C23 | P11 | C10 | H14 | 152.8° | 48.8° |
| P11 | C23 | C24 | H15 | 180.0° | 171.9° |
| P11 | C23 | C24 | H16 | 60.0° | 51.9° |
| P11 | C23 | C24 | H17 | 60.0° | 67.8° |
| P11 | C23 | C25 | H18 | 180.0° | 176.6° |
| P11 | C23 | C25 | H19 | 60.0° | 56.5° |
| P11 | C23 | C25 | H20 | 60.0° | 63.1° |
| P11 | C23 | C26 | H21 | 180.0° | 63.3° |
| P11 | C23 | C26 | H22 | 60.0° | 56.2° |
| P11 | C23 | C26 | H23 | 60.0° | 176.3° |
| C23 | P11 | PD | C1 | 173.7° | 84.5° |
| C23 | P11 | PD | C3 | 173.7° | 38.4° |
| C23 | P11 | PD | C2 | 173.7° | 21.9° |
| PD | P11 | C23 | C25 | 154.4° | 168.0° |
| PD | P11 | C23 | C26 | 82.1° | 47.5° |
| PD | P11 | C23 | C24 | 36.4° | 71.2° |
| P11 | PD | CL | C1 | 63.4° | 103.6° |
| P11 | PD | CL | C3 | 63.4° | 170.5° |
| P11 | PD | CL | C2 | 63.4° | 154.0° |
| PD | P11 | C10 | H13 | 142.6° | 46.6° |
| PD | P11 | C10 | H14 | 99.6° | 158.5° |
| P11 | PD | C2 | C1 | 90.0° | 87.0° |
| P11 | PD | C3 | C2 | 90.0° | 142.5° |
| P11 | PD | C3 | C4 | 90.0° | 31.5° |
| P11 | PD | C1 | C3 | 90.0° | 130.7° |
| P11 | PD | C1 | H39 | 90.0° | 13.0° |
| P11 | PD | C1 | H40 | 90.0° | 78.4° |
| P11 | PD | C2 | H41 | 90.0° | 173.9° |
| P11 | PD | C3 | H47 | 90.0° | 39.8° |
| C25 | C23 | C26 | C24 | 111.2° | 115.1° |
| C25 | C23 | C24 | H15 | 55.5° | 64.2° |
| C25 | C23 | C24 | H16 | 64.5° | 175.8° |
| C25 | C23 | C24 | H17 | 175.5° | 56.1° |
| C23 | C25 | H18 | H19 | 120.0° | 120.3° |
| C23 | C25 | H18 | H20 | 120.0° | 121.4° |
| C23 | C25 | H19 | H20 | 120.0° | 120.6° |
| C25 | C23 | C26 | H21 | 51.8° | 58.8° |
| C25 | C23 | C26 | H22 | 171.8° | 178.3° |
| C25 | C23 | C26 | H23 | 68.3° | 61.5° |
| C26 | C23 | C24 | H15 | 57.2° | 52.9° |
| C26 | C23 | C24 | H16 | 177.2° | 67.1° |
| C26 | C23 | C24 | H17 | 62.8° | 173.2° |
| C26 | C23 | C25 | H18 | 53.1° | 63.8° |
| C26 | C23 | C25 | H19 | 66.9° | 176.1° |
| C26 | C23 | C25 | H20 | 173.0° | 56.5° |
| C23 | C26 | H21 | H22 | 120.0° | 120.0° |
| C23 | C26 | H21 | H23 | 120.0° | 121.4° |
| C23 | C26 | H22 | H23 | 119.9° | 121.2° |
| C23 | C24 | H15 | H16 | 120.0° | 120.4° |
| C23 | C24 | H15 | H17 | 120.0° | 121.2° |
| C23 | C24 | H16 | H17 | 119.9° | 120.6° |
| C24 | C23 | C25 | H18 | 59.2° | 51.8° |
| C24 | C23 | C25 | H19 | 179.2° | 68.3° |
| C24 | C23 | C25 | H20 | 60.7° | 172.1° |
| C24 | C23 | C26 | H21 | 59.4° | 173.9° |
| C24 | C23 | C26 | H22 | 60.6° | 66.5° |
| C24 | C23 | C26 | H23 | 179.5° | 53.6° |
| CL | PD | C1 | C2 | 90.0° | 101.2° |
| CL | PD | C2 | C3 | 90.0° | 136.5° |
| CL | PD | C3 | C4 | 90.0° | 140.3° |
| CL | PD | C1 | C3 | 90.0° | 110.5° |
| CL | PD | C1 | H39 | 90.0° | 131.8° |
| CL | PD | C1 | H40 | 90.0° | 162.9° |
| CL | PD | C2 | H41 | 90.0° | 31.8° |
| CL | PD | C3 | H47 | 90.0° | 131.9° |
| H1 | C01 | C02 | H2 | 159.3° | 171.2° |
| H1 | C01 | C02 | H3 | 81.0° | 73.4° |
| H1 | C01 | C31 | H33 | 40.4° | 41.2° |
| H2 | C02 | C03 | H4 | 171.4° | 174.1° |
| H2 | C02 | C03 | H5 | 69.5° | 58.4° |
| H3 | C02 | C03 | H4 | 51.7° | 70.5° |
| H3 | C02 | C03 | H5 | 170.7° | 173.8° |
| H4 | C03 | C04 | H6 | 179.2° | 97.1° |
| H4 | C03 | C04 | H7 | 59.7° | 147.4° |
| H5 | C03 | C04 | H6 | 61.8° | 18.2° |
| H5 | C03 | C04 | H7 | 178.8° | 97.3° |
| H6 | C04 | C05 | H8 | 75.0° | 168.4° |
| H6 | C04 | C05 | H9 | 43.7° | 51.4° |
| H7 | C04 | C05 | H8 | 165.6° | 76.1° |
| H7 | C04 | C05 | H9 | 75.7° | 166.9° |
| H10 | N08 | C09 | H11 | 6.5° | 82.7° |
| H10 | N08 | C09 | H12 | 125.9° | 162.1° |
| H11 | C09 | C10 | H13 | 174.0° | 103.4° |
| H11 | C09 | C10 | H14 | 56.2° | 10.9° |
| H12 | C09 | C10 | H13 | 66.6° | 141.1° |
| H12 | C09 | C10 | H14 | 175.6° | 104.6° |
| H15 | C24 | H16 | H17 | 120.0° | 118.3° |
| H18 | C25 | H19 | H20 | 120.0° | 118.3° |
| H21 | C26 | H22 | H23 | 120.0° | 118.5° |
| H24 | C28 | H25 | H26 | 120.0° | 118.5° |
| H27 | C29 | H28 | H29 | 120.0° | 118.3° |
| H30 | C30 | H31 | H32 | 120.0° | 118.3° |
| H33 | C31 | N32 | H34 | 61.1° | 64.6° |
| H33 | C31 | C36 | H36 | 1.9° | 3.9° |
| H35 | N35 | C36 | H36 | 58.5° | 59.4° |
| H36 | C36 | C37 | H37 | 31.0° | 91.7° |
| H36 | C36 | C37 | H38 | 89.5° | 28.5° |
| C1 | C2 | C3 | H41 | 90.0° | 179.8° |
| C1 | C2 | C3 | PD | 90.0° | 13.9° |
| C1 | C2 | C3 | C4 | 90.0° | 164.6° |
| C2 | C1 | PD | H39 | 90.0° | 126.9° |
| C2 | C1 | PD | H40 | 90.0° | 61.6° |
| C2 | C1 | H39 | H40 | 90.0° | 117.1° |
| C1 | C2 | H41 | PD | 90.0° | 81.3° |
| C1 | C2 | C3 | H47 | 90.0° | 15.9° |
| C2 | C3 | C4 | PD | 90.0° | 173.1° |
| C2 | C3 | C4 | H47 | 90.0° | 179.5° |
| C2 | C3 | C4 | C5 | 90.0° | 9.4° |
| C2 | C3 | C4 | C6 | 90.0° | 169.9° |
| C2 | C3 | PD | H47 | 90.0° | 177.7° |
| C3 | C2 | C1 | H39 | 90.0° | 37.1° |
| C3 | C2 | C1 | H40 | 90.0° | 153.8° |
| C3 | C2 | H41 | PD | 90.0° | 98.6° |
| C3 | C4 | C5 | C6 | 90.0° | 179.3° |
| C3 | C4 | C6 | C11 | 90.0° | 179.7° |
| C3 | C4 | C5 | C8 | 90.0° | 179.6° |
| C4 | C3 | PD | C1 | 90.0° | 165.0° |
| C4 | C3 | PD | H47 | 90.0° | 8.3° |
| C4 | C3 | C2 | H41 | 90.0° | 15.6° |
| C3 | C4 | C5 | H42 | 90.0° | 0.9° |
| C3 | C4 | C6 | H43 | 90.0° | 0.6° |
| C5 | C4 | C6 | C11 | 90.0° | 1.0° |
| C4 | C5 | C8 | H42 | 90.0° | 178.8° |
| C4 | C5 | C8 | C9 | 90.0° | 0.8° |
| C5 | C4 | C3 | PD | 90.0° | 163.7° |
| C5 | C4 | C6 | H43 | 90.0° | 180.0° |
| C4 | C5 | C8 | H44 | 90.0° | 179.7° |
| C5 | C4 | C3 | H47 | 90.0° | 171.1° |
| C4 | C6 | C11 | H43 | 90.0° | 179.1° |
| C6 | C4 | C5 | C8 | 90.0° | 1.1° |
| C4 | C6 | C11 | C9 | 90.0° | 0.6° |
| C6 | C4 | C3 | PD | 90.0° | 17.0° |
| C6 | C4 | C5 | H42 | 90.0° | 179.8° |
| C4 | C6 | C11 | H46 | 90.0° | 179.7° |
| C6 | C4 | C3 | H47 | 90.0° | 9.6° |
| C6 | C11 | C9 | C8 | 90.0° | 0.3° |
| C6 | C11 | C9 | H46 | 90.0° | 179.7° |
| C6 | C11 | C9 | H45 | 90.0° | 179.7° |
| C5 | C8 | C9 | H44 | 90.0° | 179.5° |
| C5 | C8 | C9 | C11 | 90.0° | 0.4° |
| C5 | C8 | C9 | H45 | 90.0° | 179.6° |
| C8 | C9 | C11 | H45 | 90.0° | 180.0° |
| C9 | C8 | C5 | H42 | 90.0° | 179.5° |
| C8 | C9 | C11 | H46 | 90.0° | 180.0° |
| C9 | C11 | C6 | H43 | 90.0° | 179.7° |
| C11 | C9 | C8 | H44 | 90.0° | 179.9° |
| PD | C1 | H39 | H40 | 90.0° | 167.3° |
| C1 | PD | C3 | H47 | 90.0° | 173.3° |
| C3 | PD | C1 | H39 | 90.0° | 117.7° |
| C3 | PD | C1 | H40 | 90.0° | 52.4° |
| H39 | C1 | C2 | H41 | 90.0° | 143.1° |
| H40 | C1 | C2 | H41 | 90.0° | 26.3° |
| H41 | C2 | C3 | H47 | 90.0° | 163.9° |
| H42 | C5 | C8 | H44 | 90.0° | 0.9° |
| H43 | C6 | C11 | H46 | 90.0° | 0.6° |
| H44 | C8 | C9 | H45 | 90.0° | 0.1° |
| H45 | C9 | C11 | H46 | 90.0° | 0.0° |
