6GY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C28 | N25 | sing | 1.47Å | 1.48Å | |
| N25 | C26 | sing | 1.47Å | 1.49Å | |
| N25 | C24 | sing | 1.47Å | 1.50Å | |
| C26 | C27 | sing | 1.53Å | 1.55Å | |
| C27 | N22 | sing | 1.47Å | 1.50Å | |
| C24 | C23 | sing | 1.53Å | 1.55Å | |
| C23 | N22 | sing | 1.47Å | 1.50Å | |
| N22 | C19 | sing | 1.47Å | 1.50Å | |
| C20 | C19 | sing | 1.53Å | 1.55Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C19 | C18 | sing | 1.53Å | 1.54Å | |
| C21 | N16 | sing | 1.47Å | 1.50Å | |
| C18 | C17 | sing | 1.53Å | 1.54Å | |
| N16 | C17 | sing | 1.47Å | 1.50Å | |
| N16 | C11 | sing | 1.40Å | 1.38Å | |
| C34 | C33 | doub | 1.38Å | 1.41Å | Aromatic |
| C34 | C35 | sing | 1.38Å | 1.41Å | Aromatic |
| C33 | C32 | sing | 1.38Å | 1.42Å | Aromatic |
| C11 | C12 | doub | 1.39Å | 1.42Å | Aromatic |
| C11 | C10 | sing | 1.39Å | 1.42Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.43Å | Aromatic |
| C35 | C30 | doub | 1.39Å | 1.44Å | Aromatic |
| C10 | C9 | doub | 1.38Å | 1.41Å | Aromatic |
| C32 | C31 | doub | 1.38Å | 1.42Å | Aromatic |
| C13 | O14 | sing | 1.36Å | 1.41Å | |
| C13 | C8 | doub | 1.39Å | 1.43Å | Aromatic |
| O14 | C15 | sing | 1.43Å | 1.43Å | |
| C30 | C31 | sing | 1.39Å | 1.43Å | Aromatic |
| C30 | N29 | sing | 1.40Å | 1.38Å | |
| C9 | C8 | sing | 1.39Å | 1.43Å | Aromatic |
| C8 | N7 | sing | 1.40Å | 1.39Å | |
| C31 | P1 | sing | 1.81Å | 1.85Å | |
| N29 | C2 | sing | 1.39Å | 1.39Å | |
| N3 | C2 | doub | 1.33Å | 1.36Å | Aromatic |
| N3 | C4 | sing | 1.32Å | 1.34Å | Aromatic |
| N7 | C4 | sing | 1.38Å | 1.37Å | |
| C2 | C1 | sing | 1.40Å | 1.42Å | Aromatic |
| C4 | N5 | doub | 1.33Å | 1.35Å | Aromatic |
| C3 | P1 | sing | 1.82Å | 1.87Å | |
| P1 | O41 | doub | 1.48Å | 1.48Å | |
| P1 | C37 | sing | 1.82Å | 1.86Å | |
| C1 | C6 | doub | 1.38Å | 1.41Å | Aromatic |
| C1 | CL | sing | 1.74Å | 1.74Å | |
| N5 | C6 | sing | 1.33Å | 1.37Å | Aromatic |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C3 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C9 | H5 | sing | 1.08Å | 1.08Å | |
| C10 | H6 | sing | 1.08Å | 1.08Å | |
| C12 | H7 | sing | 1.08Å | 1.08Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C18 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H13 | sing | 1.09Å | 1.10Å | |
| C26 | H14 | sing | 1.09Å | 1.10Å | |
| N7 | H15 | sing | 0.97Å | 1.00Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C24 | H26 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| C28 | H32 | sing | 1.09Å | 1.10Å | |
| C28 | H33 | sing | 1.09Å | 1.10Å | |
| N29 | H34 | sing | 0.97Å | 1.00Å | |
| C32 | H35 | sing | 1.08Å | 1.08Å | |
| C33 | H36 | sing | 1.08Å | 1.08Å | |
| C34 | H37 | sing | 1.08Å | 1.08Å | |
| C35 | H38 | sing | 1.08Å | 1.08Å | |
| C37 | H39 | sing | 1.09Å | 1.10Å | |
| C37 | H40 | sing | 1.09Å | 1.10Å | |
| C37 | H41 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C28 | N25 | C26 | 113.2° | 111.0° |
| C28 | N25 | C24 | 112.9° | 111.0° |
| N25 | C28 | H31 | 109.5° | 109.4° |
| N25 | C28 | H32 | 109.5° | 109.5° |
| N25 | C28 | H33 | 109.5° | 109.5° |
| C26 | N25 | C24 | 112.3° | 110.9° |
| N25 | C26 | C27 | 112.1° | 109.4° |
| N25 | C26 | H13 | 108.8° | 109.4° |
| N25 | C26 | H14 | 108.8° | 109.5° |
| N25 | C24 | C23 | 110.9° | 109.4° |
| N25 | C24 | H26 | 109.1° | 109.5° |
| N25 | C24 | H27 | 109.1° | 109.4° |
| C26 | C27 | N22 | 111.8° | 109.3° |
| C27 | C26 | H13 | 108.8° | 109.4° |
| C27 | C26 | H14 | 108.8° | 109.5° |
| C26 | C27 | H29 | 108.9° | 109.6° |
| C26 | C27 | H30 | 108.9° | 109.5° |
| C27 | N22 | C23 | 113.2° | 110.9° |
| C27 | N22 | C19 | 116.0° | 111.0° |
| N22 | C27 | H29 | 108.9° | 109.5° |
| N22 | C27 | H30 | 108.9° | 109.5° |
| C24 | C23 | N22 | 111.4° | 109.3° |
| C24 | C23 | H24 | 109.0° | 109.5° |
| C24 | C23 | H25 | 109.0° | 109.5° |
| C23 | C24 | H26 | 109.1° | 109.5° |
| C23 | C24 | H27 | 109.1° | 109.5° |
| C23 | N22 | C19 | 118.2° | 111.0° |
| N22 | C23 | H24 | 109.0° | 109.5° |
| N22 | C23 | H25 | 109.0° | 109.5° |
| N22 | C19 | C20 | 117.2° | 109.6° |
| N22 | C19 | C18 | 114.0° | 109.5° |
| N22 | C19 | H18 | 105.0° | 109.5° |
| C19 | C20 | C21 | 109.6° | 109.2° |
| C20 | C19 | C18 | 110.2° | 109.2° |
| C20 | C19 | H18 | 104.4° | 109.5° |
| C19 | C20 | H19 | 109.5° | 109.5° |
| C19 | C20 | H20 | 109.4° | 109.6° |
| C20 | C21 | N16 | 110.4° | 109.6° |
| C21 | C20 | H19 | 109.4° | 109.4° |
| C21 | C20 | H20 | 109.4° | 109.5° |
| C20 | C21 | H21 | 109.2° | 109.5° |
| C20 | C21 | H22 | 109.3° | 109.5° |
| C19 | C18 | C17 | 110.2° | 109.3° |
| C19 | C18 | H11 | 109.3° | 109.5° |
| C19 | C18 | H12 | 109.3° | 109.5° |
| C18 | C19 | H18 | 104.5° | 109.5° |
| C21 | N16 | C17 | 120.5° | 111.2° |
| C21 | N16 | C11 | 119.2° | 111.0° |
| N16 | C21 | H21 | 109.2° | 109.5° |
| N16 | C21 | H22 | 109.2° | 109.4° |
| C18 | C17 | N16 | 111.8° | 109.6° |
| C17 | C18 | H11 | 109.3° | 109.5° |
| C17 | C18 | H12 | 109.3° | 109.5° |
| C18 | C17 | H16 | 108.9° | 109.5° |
| C18 | C17 | H17 | 108.8° | 109.5° |
| C17 | N16 | C11 | 117.8° | 111.0° |
| N16 | C17 | H16 | 108.9° | 109.4° |
| N16 | C17 | H17 | 108.9° | 109.5° |
| N16 | C11 | C12 | 119.7° | 120.0° |
| N16 | C11 | C10 | 120.4° | 119.9° |
| C33 | C34 | C35 | 119.6° | 120.1° |
| C34 | C33 | C32 | 120.4° | 120.1° |
| C34 | C33 | H36 | 119.8° | 119.9° |
| C33 | C34 | H37 | 120.2° | 120.0° |
| C34 | C35 | C30 | 120.9° | 119.9° |
| C35 | C34 | H37 | 120.2° | 119.9° |
| C34 | C35 | H38 | 119.6° | 120.1° |
| C33 | C32 | C31 | 120.8° | 120.1° |
| C33 | C32 | H35 | 119.6° | 119.9° |
| C32 | C33 | H36 | 119.8° | 119.9° |
| C12 | C11 | C10 | 119.8° | 120.1° |
| C11 | C12 | C13 | 120.8° | 120.0° |
| C11 | C12 | H7 | 119.6° | 120.0° |
| C11 | C10 | C9 | 119.7° | 120.1° |
| C11 | C10 | H6 | 120.1° | 120.0° |
| C12 | C13 | O14 | 125.1° | 120.0° |
| C12 | C13 | C8 | 119.1° | 119.9° |
| C13 | C12 | H7 | 119.6° | 120.0° |
| C35 | C30 | C31 | 119.1° | 119.8° |
| C35 | C30 | N29 | 122.7° | 120.1° |
| C30 | C35 | H38 | 119.6° | 120.0° |
| C10 | C9 | C8 | 121.0° | 120.1° |
| C10 | C9 | H5 | 119.5° | 120.0° |
| C9 | C10 | H6 | 120.1° | 119.9° |
| C32 | C31 | C30 | 119.2° | 119.9° |
| C32 | C31 | P1 | 118.5° | 120.1° |
| C31 | C32 | H35 | 119.6° | 120.0° |
| O14 | C13 | C8 | 115.8° | 120.1° |
| C13 | O14 | C15 | 118.7° | 117.0° |
| C13 | C8 | C9 | 119.5° | 119.9° |
| C13 | C8 | N7 | 116.3° | 120.0° |
| O14 | C15 | H8 | 109.5° | 109.5° |
| O14 | C15 | H9 | 109.5° | 109.5° |
| O14 | C15 | H10 | 109.5° | 109.5° |
| C31 | C30 | N29 | 118.2° | 120.0° |
| C30 | C31 | P1 | 122.2° | 120.0° |
| C30 | N29 | C2 | 126.7° | 120.0° |
| C30 | N29 | H34 | 116.6° | 120.1° |
| C9 | C8 | N7 | 124.1° | 120.0° |
| C8 | C9 | H5 | 119.5° | 119.9° |
| C8 | N7 | C4 | 127.5° | 120.0° |
| C8 | N7 | H15 | 116.2° | 120.0° |
| C31 | P1 | C3 | 110.3° | 109.5° |
| C31 | P1 | O41 | 111.2° | 109.5° |
| C31 | P1 | C37 | 111.5° | 109.5° |
| N29 | C2 | N3 | 119.6° | 120.5° |
| N29 | C2 | C1 | 120.9° | 120.5° |
| C2 | N29 | H34 | 116.6° | 119.9° |
| C2 | N3 | C4 | 119.8° | 120.7° |
| N3 | C2 | C1 | 119.4° | 119.0° |
| N3 | C4 | N7 | 120.4° | 119.2° |
| N3 | C4 | N5 | 124.5° | 121.7° |
| N7 | C4 | N5 | 115.1° | 119.1° |
| C4 | N7 | H15 | 116.3° | 120.0° |
| C2 | C1 | C6 | 117.2° | 118.5° |
| C2 | C1 | CL | 123.0° | 120.8° |
| C4 | N5 | C6 | 117.1° | 120.9° |
| C3 | P1 | O41 | 109.3° | 109.5° |
| C3 | P1 | C37 | 101.5° | 109.4° |
| P1 | C3 | H1 | 109.5° | 109.5° |
| P1 | C3 | H2 | 109.5° | 109.5° |
| P1 | C3 | H3 | 109.4° | 109.4° |
| O41 | P1 | C37 | 112.5° | 109.5° |
| P1 | C37 | H39 | 109.5° | 109.5° |
| P1 | C37 | H40 | 109.5° | 109.4° |
| P1 | C37 | H41 | 109.5° | 109.5° |
| C6 | C1 | CL | 119.8° | 120.8° |
| C1 | C6 | N5 | 122.0° | 119.3° |
| C1 | C6 | H4 | 119.0° | 120.3° |
| N5 | C6 | H4 | 119.0° | 120.4° |
| H1 | C3 | H2 | 109.5° | 109.5° |
| H1 | C3 | H3 | 109.5° | 109.5° |
| H2 | C3 | H3 | 109.5° | 109.5° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H8 | C15 | H10 | 109.4° | 109.5° |
| H9 | C15 | H10 | 109.5° | 109.5° |
| H11 | C18 | H12 | 109.5° | 109.5° |
| H13 | C26 | H14 | 109.5° | 109.5° |
| H16 | C17 | H17 | 109.5° | 109.4° |
| H19 | C20 | H20 | 109.5° | 109.5° |
| H21 | C21 | H22 | 109.5° | 109.4° |
| H24 | C23 | H25 | 109.5° | 109.5° |
| H26 | C24 | H27 | 109.5° | 109.5° |
| H29 | C27 | H30 | 109.5° | 109.5° |
| H31 | C28 | H32 | 109.5° | 109.5° |
| H31 | C28 | H33 | 109.4° | 109.4° |
| H32 | C28 | H33 | 109.5° | 109.5° |
| H39 | C37 | H40 | 109.4° | 109.4° |
| H39 | C37 | H41 | 109.4° | 109.5° |
| H40 | C37 | H41 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C28 | N25 | C26 | C24 | 129.3° | 123.9° |
| C28 | N25 | C26 | C27 | 176.1° | 176.8° |
| C28 | N25 | C24 | C23 | 174.5° | 176.8° |
| C28 | N25 | C26 | H13 | 55.7° | 56.9° |
| C28 | N25 | C26 | H14 | 63.5° | 63.2° |
| C28 | N25 | C24 | H26 | 65.3° | 56.8° |
| C28 | N25 | C24 | H27 | 54.3° | 63.2° |
| N25 | C28 | H31 | H32 | 120.0° | 120.0° |
| N25 | C28 | H31 | H33 | 120.0° | 120.0° |
| N25 | C28 | H32 | H33 | 120.0° | 120.1° |
| N25 | C26 | C27 | H13 | 120.4° | 119.9° |
| N25 | C26 | C27 | H14 | 120.4° | 120.0° |
| N25 | C26 | C27 | N22 | 51.3° | 58.5° |
| C26 | N25 | C24 | C23 | 56.0° | 59.3° |
| N25 | C26 | H13 | H14 | 118.8° | 120.1° |
| C26 | N25 | C24 | H26 | 64.1° | 179.3° |
| C26 | N25 | C24 | H27 | 176.3° | 60.7° |
| N25 | C26 | C27 | H29 | 69.0° | 61.5° |
| N25 | C26 | C27 | H30 | 171.6° | 178.4° |
| C26 | N25 | C28 | H31 | 180.0° | 60.0° |
| C26 | N25 | C28 | H32 | 60.0° | 180.0° |
| C26 | N25 | C28 | H33 | 60.0° | 59.9° |
| C24 | N25 | C26 | C27 | 54.6° | 59.3° |
| N25 | C24 | C23 | H26 | 120.2° | 120.0° |
| N25 | C24 | C23 | H27 | 120.2° | 119.9° |
| N25 | C24 | C23 | N22 | 54.5° | 58.4° |
| C24 | N25 | C26 | H13 | 175.0° | 179.2° |
| C24 | N25 | C26 | H14 | 65.8° | 60.7° |
| N25 | C24 | C23 | H24 | 174.8° | 61.6° |
| N25 | C24 | C23 | H25 | 65.8° | 178.4° |
| N25 | C24 | H26 | H27 | 119.4° | 120.0° |
| C24 | N25 | C28 | H31 | 51.1° | 176.2° |
| C24 | N25 | C28 | H32 | 69.0° | 56.2° |
| C24 | N25 | C28 | H33 | 171.0° | 63.9° |
| C26 | C27 | N22 | H29 | 120.3° | 120.0° |
| C26 | C27 | N22 | H30 | 120.3° | 119.9° |
| C26 | C27 | N22 | C23 | 50.8° | 59.4° |
| C26 | C27 | N22 | C19 | 167.9° | 176.8° |
| C27 | C26 | H13 | H14 | 118.8° | 120.1° |
| C26 | C27 | H29 | H30 | 118.9° | 120.1° |
| C27 | N22 | C23 | C24 | 52.6° | 59.3° |
| C27 | N22 | C23 | C19 | 140.4° | 123.9° |
| C27 | N22 | C19 | C20 | 49.5° | 176.0° |
| C27 | N22 | C19 | C18 | 179.7° | 56.2° |
| N22 | C27 | C26 | H13 | 171.7° | 178.3° |
| N22 | C27 | C26 | H14 | 69.1° | 61.6° |
| C27 | N22 | C19 | H18 | 65.9° | 63.9° |
| C27 | N22 | C23 | H24 | 172.9° | 60.6° |
| C27 | N22 | C23 | H25 | 67.7° | 179.3° |
| N22 | C27 | H29 | H30 | 118.9° | 120.0° |
| C24 | C23 | N22 | H24 | 120.3° | 119.9° |
| C24 | C23 | N22 | H25 | 120.3° | 119.9° |
| C24 | C23 | N22 | C19 | 167.0° | 176.8° |
| C24 | C23 | H24 | H25 | 119.1° | 120.0° |
| C23 | C24 | H26 | H27 | 119.3° | 120.1° |
| C23 | N22 | C19 | C20 | 89.8° | 60.2° |
| C23 | N22 | C19 | C18 | 41.0° | 180.0° |
| C23 | N22 | C19 | H18 | 154.8° | 59.9° |
| N22 | C23 | H24 | H25 | 119.1° | 120.1° |
| N22 | C23 | C24 | H26 | 65.8° | 178.4° |
| N22 | C23 | C24 | H27 | 174.7° | 61.6° |
| C23 | N22 | C27 | H29 | 69.5° | 60.7° |
| C23 | N22 | C27 | H30 | 171.1° | 179.3° |
| N22 | C19 | C20 | C18 | 132.6° | 119.9° |
| N22 | C19 | C20 | H18 | 115.6° | 120.1° |
| N22 | C19 | C20 | C21 | 165.6° | 177.6° |
| N22 | C19 | C18 | H18 | 114.1° | 120.1° |
| N22 | C19 | C18 | C17 | 165.6° | 177.6° |
| N22 | C19 | C18 | H11 | 45.5° | 57.7° |
| N22 | C19 | C18 | H12 | 74.3° | 62.4° |
| N22 | C19 | C20 | H19 | 74.4° | 57.7° |
| N22 | C19 | C20 | H20 | 45.5° | 62.4° |
| C19 | N22 | C23 | H24 | 46.7° | 63.3° |
| C19 | N22 | C23 | H25 | 72.7° | 56.8° |
| C19 | N22 | C27 | H29 | 71.8° | 63.2° |
| C19 | N22 | C27 | H30 | 47.5° | 56.9° |
| C19 | C20 | C21 | H19 | 120.0° | 119.9° |
| C19 | C20 | C21 | H20 | 120.0° | 120.0° |
| C20 | C19 | C18 | H18 | 111.7° | 119.9° |
| C19 | C20 | C21 | N16 | 51.7° | 59.2° |
| C20 | C19 | C18 | C17 | 60.2° | 57.7° |
| C20 | C19 | C18 | H11 | 179.7° | 62.3° |
| C20 | C19 | C18 | H12 | 59.9° | 177.6° |
| C19 | C20 | H19 | H20 | 120.0° | 120.2° |
| C19 | C20 | C21 | H21 | 171.8° | 60.9° |
| C19 | C20 | C21 | H22 | 68.5° | 179.2° |
| C21 | C20 | C19 | C18 | 61.9° | 57.6° |
| C20 | C21 | N16 | H21 | 120.1° | 120.1° |
| C20 | C21 | N16 | H22 | 120.2° | 120.1° |
| C20 | C21 | N16 | C17 | 44.9° | 61.7° |
| C20 | C21 | N16 | C11 | 153.5° | 174.2° |
| C21 | C20 | C19 | H18 | 49.9° | 62.3° |
| C21 | C20 | H19 | H20 | 119.9° | 120.1° |
| C20 | C21 | H21 | H22 | 119.6° | 120.0° |
| C19 | C18 | C17 | H11 | 120.1° | 119.9° |
| C19 | C18 | C17 | H12 | 120.1° | 120.0° |
| C19 | C18 | C17 | N16 | 49.0° | 59.2° |
| C19 | C18 | H11 | H12 | 119.7° | 120.1° |
| C19 | C18 | C17 | H16 | 71.4° | 60.8° |
| C19 | C18 | C17 | H17 | 169.3° | 179.2° |
| C18 | C19 | C20 | H19 | 58.2° | 62.2° |
| C18 | C19 | C20 | H20 | 178.1° | 177.6° |
| C21 | N16 | C17 | C18 | 43.7° | 61.7° |
| C21 | N16 | C17 | C11 | 161.9° | 124.2° |
| C21 | N16 | C11 | C12 | 107.3° | 55.8° |
| C21 | N16 | C11 | C10 | 73.3° | 124.2° |
| C21 | N16 | C17 | H16 | 76.7° | 58.3° |
| C21 | N16 | C17 | H17 | 164.0° | 178.2° |
| N16 | C21 | C20 | H19 | 68.4° | 60.7° |
| N16 | C21 | C20 | H20 | 171.7° | 179.2° |
| N16 | C21 | H21 | H22 | 119.5° | 119.9° |
| C18 | C17 | N16 | H16 | 120.3° | 120.0° |
| C18 | C17 | N16 | H17 | 120.3° | 120.1° |
| C18 | C17 | N16 | C11 | 154.4° | 174.1° |
| C17 | C18 | H11 | H12 | 119.7° | 120.1° |
| C18 | C17 | H16 | H17 | 118.9° | 120.0° |
| C17 | C18 | C19 | H18 | 51.5° | 62.2° |
| C17 | N16 | C11 | C12 | 90.6° | 180.0° |
| C17 | N16 | C11 | C10 | 88.8° | 0.0° |
| N16 | C17 | C18 | H11 | 169.0° | 60.7° |
| N16 | C17 | C18 | H12 | 71.2° | 179.1° |
| N16 | C17 | H16 | H17 | 119.0° | 119.9° |
| C17 | N16 | C21 | H21 | 165.0° | 58.4° |
| C17 | N16 | C21 | H22 | 75.3° | 178.2° |
| N16 | C11 | C12 | C10 | 179.4° | 180.0° |
| N16 | C11 | C12 | C13 | 179.6° | 180.0° |
| N16 | C11 | C10 | C9 | 179.6° | 180.0° |
| N16 | C11 | C10 | H6 | 0.4° | 0.0° |
| N16 | C11 | C12 | H7 | 0.4° | 0.0° |
| C11 | N16 | C17 | H16 | 85.2° | 65.8° |
| C11 | N16 | C17 | H17 | 34.1° | 54.1° |
| C11 | N16 | C21 | H21 | 33.3° | 65.8° |
| C11 | N16 | C21 | H22 | 86.4° | 54.1° |
| C33 | C34 | C35 | H37 | 180.0° | 179.8° |
| C34 | C33 | C32 | H36 | 180.0° | 180.0° |
| C33 | C34 | C35 | C30 | 0.2° | 0.5° |
| C34 | C33 | C32 | C31 | 0.2° | 0.0° |
| C34 | C33 | C32 | H35 | 179.8° | 180.0° |
| C33 | C34 | C35 | H38 | 179.8° | 180.0° |
| C35 | C34 | C33 | C32 | 0.2° | 0.2° |
| C34 | C35 | C30 | H38 | 180.0° | 179.5° |
| C34 | C35 | C30 | C31 | 0.0° | 0.5° |
| C34 | C35 | C30 | N29 | 179.9° | 179.7° |
| C35 | C34 | C33 | H36 | 179.8° | 179.8° |
| C33 | C32 | C31 | H35 | 180.0° | 180.0° |
| C33 | C32 | C31 | C30 | 0.1° | 0.0° |
| C33 | C32 | C31 | P1 | 179.4° | 180.0° |
| C32 | C33 | C34 | H37 | 179.8° | 180.0° |
| C11 | C12 | C13 | H7 | 180.0° | 180.0° |
| C12 | C11 | C10 | C9 | 0.1° | 0.0° |
| C11 | C12 | C13 | O14 | 179.9° | 179.9° |
| C11 | C12 | C13 | C8 | 0.1° | 0.0° |
| C12 | C11 | C10 | H6 | 179.9° | 179.9° |
| C10 | C11 | C12 | C13 | 0.1° | 0.0° |
| C11 | C10 | C9 | H6 | 180.0° | 179.9° |
| C11 | C10 | C9 | C8 | 0.1° | 0.0° |
| C11 | C10 | C9 | H5 | 179.9° | 179.7° |
| C10 | C11 | C12 | H7 | 179.9° | 180.0° |
| C12 | C13 | O14 | C8 | 180.0° | 180.0° |
| C12 | C13 | O14 | C15 | 33.8° | 0.0° |
| C12 | C13 | C8 | C9 | 0.0° | 0.0° |
| C12 | C13 | C8 | N7 | 180.0° | 179.7° |
| C35 | C30 | C31 | C32 | 0.0° | 0.2° |
| C35 | C30 | C31 | N29 | 179.9° | 179.8° |
| C35 | C30 | C31 | P1 | 179.3° | 179.8° |
| C35 | C30 | N29 | C2 | 49.4° | 19.6° |
| C35 | C30 | N29 | H34 | 130.6° | 160.3° |
| C30 | C35 | C34 | H37 | 179.8° | 179.7° |
| C10 | C9 | C8 | C13 | 0.0° | 0.0° |
| C10 | C9 | C8 | H5 | 180.0° | 179.7° |
| C10 | C9 | C8 | N7 | 180.0° | 179.7° |
| C32 | C31 | C30 | P1 | 179.3° | 180.0° |
| C32 | C31 | C30 | N29 | 179.9° | 180.0° |
| C32 | C31 | P1 | C3 | 24.4° | 15.0° |
| C32 | C31 | P1 | O41 | 146.0° | 135.0° |
| C32 | C31 | P1 | C37 | 87.6° | 105.0° |
| C31 | C32 | C33 | H36 | 179.8° | 180.0° |
| O14 | C13 | C8 | C9 | 180.0° | 180.0° |
| O14 | C13 | C8 | N7 | 0.0° | 0.2° |
| O14 | C13 | C12 | H7 | 0.1° | 0.1° |
| C13 | O14 | C15 | H8 | 180.0° | 60.0° |
| C13 | O14 | C15 | H9 | 60.0° | 180.0° |
| C13 | O14 | C15 | H10 | 60.0° | 60.0° |
| C8 | C13 | O14 | C15 | 146.2° | 180.0° |
| C13 | C8 | C9 | N7 | 179.9° | 179.7° |
| C13 | C8 | N7 | C4 | 158.3° | 157.2° |
| C13 | C8 | C9 | H5 | 180.0° | 179.7° |
| C8 | C13 | C12 | H7 | 179.9° | 180.0° |
| C13 | C8 | N7 | H15 | 21.7° | 22.8° |
| O14 | C15 | H8 | H9 | 120.0° | 120.0° |
| O14 | C15 | H8 | H10 | 120.0° | 120.0° |
| O14 | C15 | H9 | H10 | 120.0° | 120.0° |
| C31 | C30 | N29 | C2 | 130.7° | 160.6° |
| C30 | C31 | P1 | C3 | 154.9° | 165.0° |
| C30 | C31 | P1 | O41 | 33.4° | 45.0° |
| C30 | C31 | P1 | C37 | 93.1° | 75.0° |
| C31 | C30 | N29 | H34 | 49.3° | 19.5° |
| C30 | C31 | C32 | H35 | 179.9° | 180.0° |
| C31 | C30 | C35 | H38 | 180.0° | 180.0° |
| N29 | C30 | C31 | P1 | 0.6° | 0.0° |
| C30 | N29 | C2 | H34 | 180.0° | 179.9° |
| C30 | N29 | C2 | N3 | 14.0° | 6.9° |
| C30 | N29 | C2 | C1 | 166.0° | 173.2° |
| N29 | C30 | C35 | H38 | 0.1° | 0.2° |
| C9 | C8 | N7 | C4 | 21.6° | 23.0° |
| C8 | C9 | C10 | H6 | 179.9° | 180.0° |
| C9 | C8 | N7 | H15 | 158.3° | 156.9° |
| C8 | N7 | C4 | N3 | 13.3° | 172.7° |
| C8 | N7 | C4 | H15 | 180.0° | 179.9° |
| C8 | N7 | C4 | N5 | 166.3° | 6.8° |
| N7 | C8 | C9 | H5 | 0.0° | 0.0° |
| C31 | P1 | C3 | O41 | 122.6° | 120.0° |
| C31 | P1 | C3 | C37 | 118.4° | 120.0° |
| C31 | P1 | O41 | C37 | 126.0° | 120.0° |
| C31 | P1 | C3 | H1 | 180.0° | 60.0° |
| C31 | P1 | C3 | H2 | 60.0° | 180.0° |
| C31 | P1 | C3 | H3 | 60.0° | 60.0° |
| P1 | C31 | C32 | H35 | 0.6° | 0.0° |
| C31 | P1 | C37 | H39 | 180.0° | 180.0° |
| C31 | P1 | C37 | H40 | 60.0° | 60.0° |
| C31 | P1 | C37 | H41 | 60.0° | 59.9° |
| N29 | C2 | N3 | C1 | 180.0° | 179.9° |
| N29 | C2 | N3 | C4 | 179.8° | 179.9° |
| N29 | C2 | C1 | C6 | 179.8° | 180.0° |
| N29 | C2 | C1 | CL | 0.1° | 0.4° |
| C2 | N3 | C4 | N7 | 179.4° | 179.7° |
| C2 | N3 | C4 | N5 | 0.1° | 0.3° |
| N3 | C2 | C1 | C6 | 0.1° | 0.1° |
| N3 | C2 | C1 | CL | 180.0° | 179.7° |
| N3 | C2 | N29 | H34 | 166.0° | 173.2° |
| N3 | C4 | N7 | N5 | 179.6° | 179.4° |
| C4 | N3 | C2 | C1 | 0.2° | 0.0° |
| N3 | C4 | N5 | C6 | 0.0° | 0.6° |
| N3 | C4 | N7 | H15 | 166.7° | 7.3° |
| N7 | C4 | N5 | C6 | 179.6° | 179.9° |
| C2 | C1 | C6 | CL | 179.9° | 179.6° |
| C2 | C1 | C6 | N5 | 0.0° | 0.4° |
| C2 | C1 | C6 | H4 | 180.0° | 179.7° |
| C1 | C2 | N29 | H34 | 14.0° | 6.7° |
| C4 | N5 | C6 | C1 | 0.1° | 0.7° |
| C4 | N5 | C6 | H4 | 179.9° | 179.4° |
| N5 | C4 | N7 | H15 | 13.7° | 173.3° |
| C3 | P1 | O41 | C37 | 111.9° | 120.0° |
| P1 | C3 | H1 | H2 | 120.0° | 120.0° |
| P1 | C3 | H1 | H3 | 120.0° | 120.0° |
| P1 | C3 | H2 | H3 | 120.0° | 120.0° |
| C3 | P1 | C37 | H39 | 62.5° | 60.1° |
| C3 | P1 | C37 | H40 | 57.4° | 180.0° |
| C3 | P1 | C37 | H41 | 177.5° | 60.0° |
| O41 | P1 | C3 | H1 | 57.4° | 60.0° |
| O41 | P1 | C3 | H2 | 62.7° | 60.0° |
| O41 | P1 | C3 | H3 | 177.4° | 180.0° |
| O41 | P1 | C37 | H39 | 54.2° | 59.9° |
| O41 | P1 | C37 | H40 | 174.2° | 60.0° |
| O41 | P1 | C37 | H41 | 65.8° | 180.0° |
| C37 | P1 | C3 | H1 | 61.6° | 180.0° |
| C37 | P1 | C3 | H2 | 178.3° | 60.0° |
| C37 | P1 | C3 | H3 | 58.4° | 60.0° |
| P1 | C37 | H39 | H40 | 120.0° | 119.9° |
| P1 | C37 | H39 | H41 | 120.0° | 120.1° |
| P1 | C37 | H40 | H41 | 120.0° | 120.1° |
| C1 | C6 | N5 | H4 | 180.0° | 179.9° |
| CL | C1 | C6 | N5 | 179.9° | 180.0° |
| CL | C1 | C6 | H4 | 0.1° | 0.1° |
| H1 | C3 | H2 | H3 | 120.0° | 120.0° |
| H5 | C9 | C10 | H6 | 0.1° | 0.3° |
| H8 | C15 | H9 | H10 | 119.9° | 120.0° |
| H11 | C18 | C17 | H16 | 48.7° | 179.3° |
| H11 | C18 | C17 | H17 | 70.6° | 59.3° |
| H11 | C18 | C19 | H18 | 68.6° | 177.8° |
| H12 | C18 | C17 | H16 | 168.5° | 59.1° |
| H12 | C18 | C17 | H17 | 49.2° | 60.8° |
| H12 | C18 | C19 | H18 | 171.6° | 57.7° |
| H13 | C26 | C27 | H29 | 51.3° | 58.3° |
| H13 | C26 | C27 | H30 | 68.0° | 61.7° |
| H14 | C26 | C27 | H29 | 170.6° | 178.4° |
| H14 | C26 | C27 | H30 | 51.3° | 58.3° |
| H18 | C19 | C20 | H19 | 169.9° | 177.8° |
| H18 | C19 | C20 | H20 | 70.1° | 57.7° |
| H19 | C20 | C21 | H21 | 51.8° | 179.2° |
| H19 | C20 | C21 | H22 | 171.5° | 59.3° |
| H20 | C20 | C21 | H21 | 68.2° | 59.1° |
| H20 | C20 | C21 | H22 | 51.6° | 60.8° |
| H24 | C23 | C24 | H26 | 54.6° | 58.4° |
| H24 | C23 | C24 | H27 | 65.0° | 178.5° |
| H25 | C23 | C24 | H26 | 174.0° | 61.6° |
| H25 | C23 | C24 | H27 | 54.4° | 58.4° |
| H31 | C28 | H32 | H33 | 120.0° | 120.0° |
| H35 | C32 | C33 | H36 | 0.2° | 0.0° |
| H36 | C33 | C34 | H37 | 0.2° | 0.0° |
| H37 | C34 | C35 | H38 | 0.2° | 0.2° |
| H39 | C37 | H40 | H41 | 119.9° | 120.0° |
