ZQQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C34 | C33 | sing | 1.53Å | 1.56Å | |
| C34 | C35 | sing | 1.53Å | 1.55Å | |
| C33 | N31 | sing | 1.47Å | 1.45Å | |
| N31 | C30 | sing | 1.35Å | 1.39Å | |
| C35 | N36 | sing | 1.47Å | 1.56Å | |
| C03 | C04 | doub | 1.36Å | 1.40Å | Aromatic |
| C03 | N02 | sing | 1.33Å | 1.39Å | Aromatic |
| C04 | N05 | sing | 1.36Å | 1.39Å | Aromatic |
| C37 | N36 | sing | 1.47Å | 1.53Å | |
| N36 | C38 | sing | 1.47Å | 1.52Å | |
| N02 | C01 | doub | 1.32Å | 1.37Å | Aromatic |
| C30 | O32 | doub | 1.21Å | 1.23Å | |
| C30 | C29 | sing | 1.51Å | 1.51Å | |
| N05 | C01 | sing | 1.37Å | 1.42Å | Aromatic |
| N05 | C06 | sing | 1.46Å | 1.46Å | |
| C01 | C07 | sing | 1.47Å | 1.51Å | |
| C29 | C28 | sing | 1.53Å | 1.55Å | |
| C28 | N27 | sing | 1.47Å | 1.46Å | |
| C07 | N08 | sing | 1.35Å | 1.39Å | |
| C07 | O09 | doub | 1.22Å | 1.23Å | |
| N08 | C10 | sing | 1.41Å | 1.43Å | |
| N27 | C25 | sing | 1.35Å | 1.40Å | |
| C10 | C14 | sing | 1.40Å | 1.43Å | Aromatic |
| C10 | C11 | doub | 1.36Å | 1.41Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C19 | sing | 1.40Å | 1.41Å | Aromatic |
| C25 | O26 | doub | 1.22Å | 1.23Å | |
| C25 | C22 | sing | 1.47Å | 1.49Å | |
| C22 | N21 | sing | 1.38Å | 1.43Å | Aromatic |
| N17 | C19 | sing | 1.41Å | 1.42Å | |
| N17 | C16 | sing | 1.35Å | 1.40Å | |
| C11 | N12 | sing | 1.36Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.36Å | 1.41Å | Aromatic |
| C13 | C16 | sing | 1.47Å | 1.51Å | |
| C13 | N12 | sing | 1.38Å | 1.43Å | Aromatic |
| C16 | O18 | doub | 1.22Å | 1.23Å | |
| N12 | C15 | sing | 1.46Å | 1.47Å | |
| N21 | C20 | sing | 1.36Å | 1.39Å | Aromatic |
| N21 | C24 | sing | 1.46Å | 1.47Å | |
| C03 | H1 | sing | 1.08Å | 1.08Å | |
| C04 | H2 | sing | 1.08Å | 1.08Å | |
| C06 | H3 | sing | 1.09Å | 1.10Å | |
| C06 | H4 | sing | 1.09Å | 1.10Å | |
| C06 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.08Å | 1.08Å | |
| C14 | 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 | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C23 | H12 | sing | 1.08Å | 1.08Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C28 | H16 | sing | 1.09Å | 1.10Å | |
| C28 | H17 | sing | 1.09Å | 1.10Å | |
| C29 | H18 | sing | 1.09Å | 1.10Å | |
| C29 | H19 | sing | 1.09Å | 1.10Å | |
| C33 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.09Å | 1.10Å | |
| C34 | H22 | sing | 1.09Å | 1.10Å | |
| C34 | H23 | sing | 1.09Å | 1.10Å | |
| C35 | H24 | sing | 1.09Å | 1.10Å | |
| C35 | H25 | sing | 1.09Å | 1.10Å | |
| C37 | H26 | sing | 1.09Å | 1.10Å | |
| C37 | H27 | sing | 1.09Å | 1.10Å | |
| C37 | H28 | sing | 1.09Å | 1.10Å | |
| C38 | H29 | sing | 1.09Å | 1.10Å | |
| C38 | H30 | sing | 1.09Å | 1.10Å | |
| C38 | H31 | sing | 1.09Å | 1.10Å | |
| N08 | H32 | sing | 0.97Å | 1.00Å | |
| N17 | H33 | sing | 0.97Å | 1.00Å | |
| N27 | H34 | sing | 0.97Å | 1.00Å | |
| N31 | H35 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C33 | C34 | C35 | 114.8° | 109.5° |
| C34 | C33 | N31 | 114.3° | 109.5° |
| C34 | C33 | H20 | 108.2° | 109.5° |
| C34 | C33 | H21 | 108.2° | 109.5° |
| C33 | C34 | H22 | 108.1° | 109.5° |
| C33 | C34 | H23 | 108.1° | 109.5° |
| C34 | C35 | N36 | 113.6° | 109.5° |
| C35 | C34 | H22 | 108.1° | 109.5° |
| C35 | C34 | H23 | 108.1° | 109.4° |
| C34 | C35 | H24 | 108.4° | 109.4° |
| C34 | C35 | H25 | 108.4° | 109.4° |
| C33 | N31 | C30 | 121.1° | 120.0° |
| N31 | C33 | H20 | 108.3° | 109.5° |
| N31 | C33 | H21 | 108.3° | 109.4° |
| C33 | N31 | H35 | 119.4° | 120.0° |
| N31 | C30 | O32 | 118.1° | 120.0° |
| N31 | C30 | C29 | 119.2° | 120.0° |
| C30 | N31 | H35 | 119.5° | 120.0° |
| C35 | N36 | C37 | 111.0° | 111.0° |
| C35 | N36 | C38 | 110.9° | 111.0° |
| N36 | C35 | H24 | 108.4° | 109.5° |
| N36 | C35 | H25 | 108.4° | 109.5° |
| C04 | C03 | N02 | 110.4° | 108.4° |
| C03 | C04 | N05 | 106.0° | 107.1° |
| C04 | C03 | H1 | 124.8° | 125.9° |
| C03 | C04 | H2 | 127.0° | 126.4° |
| C03 | N02 | C01 | 106.8° | 109.2° |
| N02 | C03 | H1 | 124.8° | 125.8° |
| C04 | N05 | C01 | 108.1° | 107.0° |
| C04 | N05 | C06 | 121.7° | 126.5° |
| N05 | C04 | H2 | 127.0° | 126.5° |
| C37 | N36 | C38 | 108.3° | 111.0° |
| N36 | C37 | H26 | 109.5° | 109.5° |
| N36 | C37 | H27 | 109.4° | 109.5° |
| N36 | C37 | H28 | 109.5° | 109.5° |
| N36 | C38 | H29 | 109.5° | 109.4° |
| N36 | C38 | H30 | 109.5° | 109.5° |
| N36 | C38 | H31 | 109.4° | 109.5° |
| N02 | C01 | N05 | 108.8° | 108.3° |
| N02 | C01 | C07 | 127.6° | 125.8° |
| O32 | C30 | C29 | 122.7° | 120.0° |
| C30 | C29 | C28 | 115.1° | 109.5° |
| C30 | C29 | H18 | 108.0° | 109.4° |
| C30 | C29 | H19 | 108.1° | 109.5° |
| C01 | N05 | C06 | 130.2° | 126.5° |
| N05 | C01 | C07 | 123.6° | 125.9° |
| N05 | C06 | H3 | 109.5° | 109.5° |
| N05 | C06 | H4 | 109.4° | 109.5° |
| N05 | C06 | H5 | 109.5° | 109.5° |
| C01 | C07 | N08 | 118.6° | 120.0° |
| C01 | C07 | O09 | 119.9° | 120.0° |
| C29 | C28 | N27 | 109.9° | 109.5° |
| C29 | C28 | H16 | 109.3° | 109.5° |
| C29 | C28 | H17 | 109.4° | 109.5° |
| C28 | C29 | H18 | 108.1° | 109.5° |
| C28 | C29 | H19 | 108.0° | 109.4° |
| C28 | N27 | C25 | 121.7° | 120.0° |
| N27 | C28 | H16 | 109.4° | 109.5° |
| N27 | C28 | H17 | 109.4° | 109.5° |
| C28 | N27 | H34 | 119.2° | 119.9° |
| N08 | C07 | O09 | 121.5° | 120.0° |
| C07 | N08 | C10 | 129.9° | 120.0° |
| C07 | N08 | H32 | 115.0° | 120.0° |
| N08 | C10 | C14 | 126.8° | 126.1° |
| N08 | C10 | C11 | 127.4° | 126.1° |
| C10 | N08 | H32 | 115.1° | 120.0° |
| N27 | C25 | O26 | 117.8° | 120.0° |
| N27 | C25 | C22 | 116.8° | 120.0° |
| C25 | N27 | H34 | 119.1° | 120.0° |
| C14 | C10 | C11 | 105.8° | 107.7° |
| C10 | C14 | C13 | 110.6° | 107.1° |
| C10 | C14 | H7 | 124.7° | 126.4° |
| C10 | C11 | N12 | 109.0° | 108.8° |
| C10 | C11 | H6 | 125.5° | 125.6° |
| C14 | C13 | C16 | 131.1° | 126.2° |
| C14 | C13 | N12 | 105.3° | 107.7° |
| C13 | C14 | H7 | 124.7° | 126.5° |
| C22 | C23 | C19 | 110.4° | 107.1° |
| C23 | C22 | C25 | 129.4° | 126.2° |
| C23 | C22 | N21 | 106.2° | 107.7° |
| C22 | C23 | H12 | 124.8° | 126.4° |
| C23 | C19 | N17 | 128.3° | 126.2° |
| C23 | C19 | C20 | 105.7° | 107.7° |
| C19 | C23 | H12 | 124.8° | 126.5° |
| O26 | C25 | C22 | 125.5° | 120.0° |
| C25 | C22 | N21 | 124.4° | 126.2° |
| C22 | N21 | C20 | 108.4° | 108.7° |
| C22 | N21 | C24 | 127.3° | 125.6° |
| C19 | N17 | C16 | 132.2° | 119.9° |
| N17 | C19 | C20 | 125.9° | 126.1° |
| C19 | N17 | H33 | 113.9° | 120.0° |
| N17 | C16 | C13 | 118.3° | 120.0° |
| N17 | C16 | O18 | 119.2° | 120.0° |
| C16 | N17 | H33 | 113.9° | 120.0° |
| C11 | N12 | C13 | 109.3° | 108.7° |
| C11 | N12 | C15 | 122.4° | 125.7° |
| N12 | C11 | H6 | 125.5° | 125.6° |
| C19 | C20 | N21 | 109.3° | 108.8° |
| C19 | C20 | H11 | 125.4° | 125.6° |
| C16 | C13 | N12 | 123.6° | 126.1° |
| C13 | C16 | O18 | 122.4° | 120.0° |
| C13 | N12 | C15 | 128.3° | 125.6° |
| N12 | C15 | H8 | 109.5° | 109.5° |
| N12 | C15 | H9 | 109.5° | 109.5° |
| N12 | C15 | H10 | 109.5° | 109.5° |
| C20 | N21 | C24 | 124.3° | 125.7° |
| N21 | C20 | H11 | 125.3° | 125.6° |
| N21 | C24 | H13 | 109.5° | 109.5° |
| N21 | C24 | H14 | 109.4° | 109.4° |
| N21 | C24 | H15 | 109.5° | 109.5° |
| H3 | C06 | H4 | 109.5° | 109.5° |
| H3 | C06 | H5 | 109.4° | 109.4° |
| H4 | C06 | H5 | 109.5° | 109.5° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H8 | C15 | H10 | 109.5° | 109.4° |
| H9 | C15 | H10 | 109.5° | 109.5° |
| H13 | C24 | H14 | 109.5° | 109.5° |
| H13 | C24 | H15 | 109.5° | 109.5° |
| H14 | C24 | H15 | 109.5° | 109.5° |
| H16 | C28 | H17 | 109.4° | 109.4° |
| H18 | C29 | H19 | 109.5° | 109.6° |
| H20 | C33 | H21 | 109.5° | 109.5° |
| H22 | C34 | H23 | 109.5° | 109.4° |
| H24 | C35 | H25 | 109.5° | 109.5° |
| H26 | C37 | H27 | 109.4° | 109.4° |
| H26 | C37 | H28 | 109.5° | 109.5° |
| H27 | C37 | H28 | 109.5° | 109.4° |
| H29 | C38 | H30 | 109.5° | 109.5° |
| H29 | C38 | H31 | 109.5° | 109.5° |
| H30 | C38 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C33 | C34 | C35 | H22 | 120.8° | 120.1° |
| C33 | C34 | C35 | H23 | 120.8° | 120.0° |
| C34 | C33 | N31 | H20 | 120.7° | 120.0° |
| C34 | C33 | N31 | H21 | 120.7° | 120.0° |
| C34 | C33 | N31 | C30 | 96.6° | 180.0° |
| C33 | C34 | C35 | N36 | 33.6° | 180.0° |
| C34 | C33 | H20 | H21 | 117.8° | 120.0° |
| C33 | C34 | H22 | H23 | 117.6° | 120.0° |
| C33 | C34 | C35 | H24 | 154.2° | 59.9° |
| C33 | C34 | C35 | H25 | 87.0° | 60.0° |
| C34 | C33 | N31 | H35 | 83.4° | 0.1° |
| C35 | C34 | C33 | N31 | 69.0° | 180.0° |
| C34 | C35 | N36 | H24 | 120.6° | 120.0° |
| C34 | C35 | N36 | H25 | 120.6° | 120.0° |
| C34 | C35 | N36 | C37 | 68.0° | 170.0° |
| C34 | C35 | N36 | C38 | 171.6° | 66.0° |
| C35 | C34 | C33 | H20 | 170.3° | 60.0° |
| C35 | C34 | C33 | H21 | 51.7° | 60.0° |
| C35 | C34 | H22 | H23 | 117.6° | 119.9° |
| C34 | C35 | H24 | H25 | 118.1° | 119.9° |
| C33 | N31 | C30 | H35 | 180.0° | 179.9° |
| C33 | N31 | C30 | O32 | 0.2° | 0.0° |
| C33 | N31 | C30 | C29 | 179.9° | 180.0° |
| N31 | C33 | H20 | H21 | 117.8° | 120.0° |
| N31 | C33 | C34 | H22 | 170.2° | 60.0° |
| N31 | C33 | C34 | H23 | 51.8° | 60.0° |
| N31 | C30 | O32 | C29 | 179.9° | 180.0° |
| N31 | C30 | C29 | C28 | 95.6° | 180.0° |
| N31 | C30 | C29 | H18 | 25.2° | 60.1° |
| N31 | C30 | C29 | H19 | 143.6° | 60.0° |
| C30 | N31 | C33 | H20 | 142.7° | 59.9° |
| C30 | N31 | C33 | H21 | 24.1° | 60.0° |
| C35 | N36 | C37 | C38 | 121.9° | 123.9° |
| N36 | C35 | C34 | H22 | 87.2° | 59.9° |
| N36 | C35 | C34 | H23 | 154.4° | 60.0° |
| N36 | C35 | H24 | H25 | 118.1° | 120.0° |
| C35 | N36 | C37 | H26 | 180.0° | 60.0° |
| C35 | N36 | C37 | H27 | 60.0° | 180.0° |
| C35 | N36 | C37 | H28 | 60.0° | 60.0° |
| C35 | N36 | C38 | H29 | 180.0° | 60.0° |
| C35 | N36 | C38 | H30 | 60.0° | 180.0° |
| C35 | N36 | C38 | H31 | 60.0° | 60.0° |
| C04 | C03 | N02 | H1 | 180.0° | 180.0° |
| C03 | C04 | N05 | H2 | 180.0° | 180.0° |
| C04 | C03 | N02 | C01 | 0.4° | 0.2° |
| C03 | C04 | N05 | C01 | 0.3° | 0.1° |
| C03 | C04 | N05 | C06 | 179.9° | 180.0° |
| N02 | C03 | C04 | N05 | 0.1° | 0.0° |
| C03 | N02 | C01 | N05 | 0.6° | 0.3° |
| C03 | N02 | C01 | C07 | 179.6° | 180.0° |
| N02 | C03 | C04 | H2 | 179.9° | 180.0° |
| C04 | N05 | C01 | N02 | 0.6° | 0.2° |
| C04 | N05 | C01 | C06 | 179.7° | 179.9° |
| C04 | N05 | C01 | C07 | 179.6° | 179.9° |
| N05 | C04 | C03 | H1 | 179.9° | 180.0° |
| C04 | N05 | C06 | H3 | 180.0° | 89.9° |
| C04 | N05 | C06 | H4 | 60.0° | 150.0° |
| C04 | N05 | C06 | H5 | 60.0° | 30.0° |
| C37 | N36 | C35 | H24 | 52.6° | 50.0° |
| C37 | N36 | C35 | H25 | 171.4° | 70.0° |
| N36 | C37 | H26 | H27 | 120.0° | 120.0° |
| N36 | C37 | H26 | H28 | 120.0° | 120.1° |
| N36 | C37 | H27 | H28 | 120.0° | 120.0° |
| C37 | N36 | C38 | H29 | 58.0° | 176.0° |
| C37 | N36 | C38 | H30 | 62.0° | 56.1° |
| C37 | N36 | C38 | H31 | 178.1° | 63.9° |
| C38 | N36 | C35 | H24 | 67.8° | 173.9° |
| C38 | N36 | C35 | H25 | 51.0° | 53.9° |
| C38 | N36 | C37 | H26 | 58.1° | 63.9° |
| C38 | N36 | C37 | H27 | 178.1° | 56.1° |
| C38 | N36 | C37 | H28 | 61.9° | 176.0° |
| N36 | C38 | H29 | H30 | 120.0° | 120.0° |
| N36 | C38 | H29 | H31 | 120.0° | 120.0° |
| N36 | C38 | H30 | H31 | 119.9° | 120.0° |
| N02 | C01 | N05 | C07 | 179.0° | 179.7° |
| N02 | C01 | N05 | C06 | 179.6° | 179.9° |
| N02 | C01 | C07 | N08 | 29.9° | 0.1° |
| N02 | C01 | C07 | O09 | 149.3° | 180.0° |
| C01 | N02 | C03 | H1 | 179.6° | 179.8° |
| O32 | C30 | C29 | C28 | 84.3° | 0.0° |
| O32 | C30 | C29 | H18 | 154.9° | 119.9° |
| O32 | C30 | C29 | H19 | 36.5° | 120.0° |
| O32 | C30 | N31 | H35 | 179.8° | 179.9° |
| C30 | C29 | C28 | H18 | 120.8° | 119.9° |
| C30 | C29 | C28 | H19 | 120.8° | 120.0° |
| C30 | C29 | C28 | N27 | 174.5° | 180.0° |
| C30 | C29 | C28 | H16 | 65.4° | 60.0° |
| C30 | C29 | C28 | H17 | 54.4° | 60.0° |
| C30 | C29 | H18 | H19 | 117.4° | 120.0° |
| C29 | C30 | N31 | H35 | 0.1° | 0.1° |
| N05 | C01 | C07 | N08 | 148.9° | 179.7° |
| N05 | C01 | C07 | O09 | 31.8° | 0.4° |
| C01 | N05 | C04 | H2 | 179.7° | 179.9° |
| C01 | N05 | C06 | H3 | 0.3° | 90.2° |
| C01 | N05 | C06 | H4 | 120.3° | 29.8° |
| C01 | N05 | C06 | H5 | 119.7° | 149.8° |
| C06 | N05 | C01 | C07 | 0.6° | 0.2° |
| C06 | N05 | C04 | H2 | 0.1° | 0.0° |
| N05 | C06 | H3 | H4 | 120.0° | 120.0° |
| N05 | C06 | H3 | H5 | 120.0° | 120.0° |
| N05 | C06 | H4 | H5 | 120.0° | 120.0° |
| C01 | C07 | N08 | O09 | 179.2° | 179.9° |
| C01 | C07 | N08 | C10 | 179.8° | 179.9° |
| C01 | C07 | N08 | H32 | 0.2° | 0.0° |
| C29 | C28 | N27 | H16 | 120.1° | 120.0° |
| C29 | C28 | N27 | H17 | 120.1° | 120.1° |
| C29 | C28 | N27 | C25 | 94.4° | 180.0° |
| C29 | C28 | H16 | H17 | 119.8° | 120.0° |
| C28 | C29 | H18 | H19 | 117.4° | 120.0° |
| C29 | C28 | N27 | H34 | 85.7° | 0.1° |
| C28 | N27 | C25 | H34 | 180.0° | 180.0° |
| C28 | N27 | C25 | O26 | 0.3° | 5.0° |
| C28 | N27 | C25 | C22 | 179.6° | 175.0° |
| N27 | C28 | H16 | H17 | 119.8° | 120.0° |
| N27 | C28 | C29 | H18 | 53.7° | 60.0° |
| N27 | C28 | C29 | H19 | 64.7° | 60.1° |
| C07 | N08 | C10 | H32 | 180.0° | 179.9° |
| C07 | N08 | C10 | C14 | 179.4° | 0.0° |
| C07 | N08 | C10 | C11 | 1.6° | 179.7° |
| O09 | C07 | N08 | C10 | 1.0° | 0.0° |
| O09 | C07 | N08 | H32 | 179.0° | 179.9° |
| N08 | C10 | C14 | C11 | 179.2° | 179.8° |
| N08 | C10 | C14 | C13 | 179.5° | 179.8° |
| N08 | C10 | C11 | N12 | 179.4° | 179.8° |
| N08 | C10 | C11 | H6 | 0.5° | 0.2° |
| N08 | C10 | C14 | H7 | 0.5° | 0.2° |
| N27 | C25 | C22 | C23 | 8.0° | 5.1° |
| N27 | C25 | O26 | C22 | 179.2° | 179.9° |
| N27 | C25 | C22 | N21 | 172.2° | 174.8° |
| C25 | N27 | C28 | H16 | 25.7° | 60.0° |
| C25 | N27 | C28 | H17 | 145.5° | 60.0° |
| C10 | C14 | C13 | H7 | 180.0° | 180.0° |
| C14 | C10 | C11 | N12 | 0.3° | 0.0° |
| C10 | C14 | C13 | C16 | 179.9° | 180.0° |
| C10 | C14 | C13 | N12 | 0.2° | 0.0° |
| C14 | C10 | C11 | H6 | 179.7° | 180.0° |
| C14 | C10 | N08 | H32 | 0.6° | 179.9° |
| C11 | C10 | C14 | C13 | 0.3° | 0.0° |
| C10 | C11 | N12 | H6 | 180.0° | 180.0° |
| C10 | C11 | N12 | C13 | 0.2° | 0.0° |
| C10 | C11 | N12 | C15 | 179.9° | 180.0° |
| C11 | C10 | C14 | H7 | 179.7° | 180.0° |
| C11 | C10 | N08 | H32 | 178.4° | 0.2° |
| C14 | C13 | C16 | N17 | 16.0° | 5.0° |
| C14 | C13 | N12 | C11 | 0.0° | 0.0° |
| C14 | C13 | C16 | N12 | 179.9° | 180.0° |
| C14 | C13 | C16 | O18 | 163.0° | 175.0° |
| C14 | C13 | N12 | C15 | 179.9° | 180.0° |
| C22 | C23 | C19 | H12 | 180.0° | 180.0° |
| C23 | C22 | C25 | O26 | 171.2° | 174.8° |
| C23 | C22 | C25 | N21 | 179.8° | 179.9° |
| C22 | C23 | C19 | N17 | 179.7° | 179.7° |
| C22 | C23 | C19 | C20 | 0.1° | 0.0° |
| C23 | C22 | N21 | C20 | 0.1° | 0.1° |
| C23 | C22 | N21 | C24 | 179.9° | 180.0° |
| C19 | C23 | C22 | C25 | 179.9° | 180.0° |
| C19 | C23 | C22 | N21 | 0.1° | 0.1° |
| C23 | C19 | N17 | C20 | 179.6° | 179.6° |
| C23 | C19 | N17 | C16 | 168.9° | 0.4° |
| C23 | C19 | C20 | N21 | 0.1° | 0.0° |
| C23 | C19 | C20 | H11 | 179.9° | 179.9° |
| C23 | C19 | N17 | H33 | 11.1° | 179.7° |
| O26 | C25 | C22 | N21 | 8.6° | 5.2° |
| O26 | C25 | N27 | H34 | 179.7° | 174.9° |
| C25 | C22 | N21 | C20 | 179.9° | 180.0° |
| C25 | C22 | N21 | C24 | 0.3° | 0.1° |
| C25 | C22 | C23 | H12 | 0.1° | 0.0° |
| C22 | C25 | N27 | H34 | 0.4° | 5.0° |
| C22 | N21 | C20 | C19 | 0.0° | 0.1° |
| C22 | N21 | C20 | C24 | 179.8° | 179.9° |
| C22 | N21 | C20 | H11 | 180.0° | 180.0° |
| N21 | C22 | C23 | H12 | 179.9° | 180.0° |
| C22 | N21 | C24 | H13 | 180.0° | 94.7° |
| C22 | N21 | C24 | H14 | 60.0° | 145.3° |
| C22 | N21 | C24 | H15 | 60.0° | 25.4° |
| C19 | N17 | C16 | H33 | 180.0° | 180.0° |
| C19 | N17 | C16 | C13 | 179.6° | 174.7° |
| C19 | N17 | C16 | O18 | 0.5° | 5.3° |
| N17 | C19 | C20 | N21 | 179.7° | 179.7° |
| N17 | C19 | C20 | H11 | 0.3° | 0.2° |
| N17 | C19 | C23 | H12 | 0.3° | 0.3° |
| C16 | N17 | C19 | C20 | 11.6° | 180.0° |
| N17 | C16 | C13 | O18 | 179.1° | 180.0° |
| N17 | C16 | C13 | N12 | 163.9° | 175.0° |
| C11 | N12 | C13 | C16 | 180.0° | 180.0° |
| C11 | N12 | C13 | C15 | 179.9° | 180.0° |
| C11 | N12 | C15 | H8 | 180.0° | 95.2° |
| C11 | N12 | C15 | H9 | 60.0° | 144.7° |
| C11 | N12 | C15 | H10 | 60.0° | 24.7° |
| C19 | C20 | N21 | H11 | 180.0° | 179.9° |
| C19 | C20 | N21 | C24 | 179.8° | 180.0° |
| C20 | C19 | C23 | H12 | 179.9° | 180.0° |
| C20 | C19 | N17 | H33 | 168.4° | 0.0° |
| C16 | C13 | N12 | C15 | 0.1° | 0.0° |
| C16 | C13 | C14 | H7 | 0.2° | 0.1° |
| C13 | C16 | N17 | H33 | 0.5° | 5.3° |
| N12 | C13 | C16 | O18 | 17.1° | 5.0° |
| C13 | N12 | C11 | H6 | 179.8° | 180.0° |
| N12 | C13 | C14 | H7 | 179.8° | 180.0° |
| C13 | N12 | C15 | H8 | 0.1° | 84.8° |
| C13 | N12 | C15 | H9 | 119.9° | 35.2° |
| C13 | N12 | C15 | H10 | 120.1° | 155.2° |
| O18 | C16 | N17 | H33 | 179.5° | 174.7° |
| C15 | N12 | C11 | H6 | 0.1° | 0.0° |
| N12 | C15 | H8 | H9 | 120.0° | 120.1° |
| N12 | C15 | H8 | H10 | 120.0° | 120.0° |
| N12 | C15 | H9 | H10 | 120.0° | 120.0° |
| C20 | N21 | C24 | H13 | 0.2° | 85.2° |
| C20 | N21 | C24 | H14 | 120.2° | 34.8° |
| C20 | N21 | C24 | H15 | 119.8° | 154.7° |
| C24 | N21 | C20 | H11 | 0.2° | 0.1° |
| N21 | C24 | H13 | H14 | 120.0° | 119.9° |
| N21 | C24 | H13 | H15 | 120.0° | 120.0° |
| N21 | C24 | H14 | H15 | 120.0° | 119.9° |
| H1 | C03 | C04 | H2 | 0.1° | 0.0° |
| H3 | C06 | H4 | H5 | 120.0° | 120.0° |
| H8 | C15 | H9 | H10 | 120.0° | 119.9° |
| H13 | C24 | H14 | H15 | 120.0° | 120.1° |
| H16 | C28 | C29 | H18 | 173.8° | 60.0° |
| H16 | C28 | C29 | H19 | 55.4° | 179.9° |
| H16 | C28 | N27 | H34 | 154.3° | 120.1° |
| H17 | C28 | C29 | H18 | 66.4° | 179.9° |
| H17 | C28 | C29 | H19 | 175.3° | 60.0° |
| H17 | C28 | N27 | H34 | 34.4° | 120.0° |
| H20 | C33 | C34 | H22 | 49.5° | 60.0° |
| H20 | C33 | C34 | H23 | 68.9° | 180.0° |
| H20 | C33 | N31 | H35 | 37.3° | 120.0° |
| H21 | C33 | C34 | H22 | 69.0° | 180.0° |
| H21 | C33 | C34 | H23 | 172.5° | 60.0° |
| H21 | C33 | N31 | H35 | 155.9° | 120.1° |
| H22 | C34 | C35 | H24 | 33.4° | 180.0° |
| H22 | C34 | C35 | H25 | 152.2° | 60.1° |
| H23 | C34 | C35 | H24 | 85.0° | 60.1° |
| H23 | C34 | C35 | H25 | 33.8° | 180.0° |
| H26 | C37 | H27 | H28 | 120.0° | 119.9° |
| H29 | C38 | H30 | H31 | 120.0° | 120.0° |
