V0P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C15 | doub | 1.38Å | 1.41Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| N01 | C02 | sing | 1.39Å | 1.41Å | |
| C03 | C02 | doub | 1.39Å | 1.39Å | Aromatic |
| C03 | C04 | sing | 1.38Å | 1.39Å | Aromatic |
| C02 | N31 | sing | 1.32Å | 1.37Å | Aromatic |
| C13 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
| C04 | C05 | doub | 1.39Å | 1.40Å | Aromatic |
| C16 | O17 | sing | 1.36Å | 1.42Å | |
| C16 | C30 | doub | 1.39Å | 1.42Å | Aromatic |
| N31 | C06 | doub | 1.32Å | 1.36Å | Aromatic |
| O17 | C18 | sing | 1.43Å | 1.44Å | |
| C20 | C21 | doub | 1.36Å | 1.41Å | Aromatic |
| C20 | C19 | sing | 1.39Å | 1.42Å | Aromatic |
| C05 | C06 | sing | 1.38Å | 1.40Å | Aromatic |
| C06 | C07 | sing | 1.51Å | 1.50Å | |
| C21 | C22 | sing | 1.40Å | 1.44Å | Aromatic |
| C12 | C30 | sing | 1.39Å | 1.41Å | Aromatic |
| C12 | O11 | sing | 1.36Å | 1.41Å | |
| N08 | C07 | sing | 1.47Å | 1.45Å | |
| N08 | C09 | sing | 1.47Å | 1.46Å | |
| C18 | C19 | sing | 1.51Å | 1.57Å | |
| C19 | C29 | doub | 1.36Å | 1.39Å | Aromatic |
| O11 | C10 | sing | 1.43Å | 1.43Å | |
| C22 | C23 | doub | 1.41Å | 1.43Å | Aromatic |
| C22 | C28 | sing | 1.42Å | 1.39Å | Aromatic |
| C23 | C24 | sing | 1.36Å | 1.41Å | Aromatic |
| C09 | C10 | sing | 1.53Å | 1.54Å | |
| C29 | C28 | sing | 1.41Å | 1.43Å | Aromatic |
| C28 | N27 | doub | 1.34Å | 1.39Å | Aromatic |
| C24 | C25 | doub | 1.40Å | 1.45Å | Aromatic |
| N27 | C25 | sing | 1.32Å | 1.33Å | Aromatic |
| C25 | N26 | sing | 1.39Å | 1.42Å | |
| C03 | H1 | sing | 1.08Å | 1.08Å | |
| C04 | H2 | sing | 1.08Å | 1.08Å | |
| C05 | H3 | sing | 1.08Å | 1.08Å | |
| C07 | H4 | sing | 1.09Å | 1.10Å | |
| C07 | H5 | sing | 1.09Å | 1.10Å | |
| C09 | H6 | sing | 1.09Å | 1.10Å | |
| C09 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.08Å | 1.08Å | |
| C14 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H12 | sing | 1.08Å | 1.08Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.08Å | 1.08Å | |
| C21 | H16 | sing | 1.08Å | 1.08Å | |
| C23 | H17 | sing | 1.08Å | 1.08Å | |
| C24 | H18 | sing | 1.08Å | 1.08Å | |
| C29 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| N01 | H21 | sing | 0.97Å | 1.00Å | |
| N01 | H22 | sing | 0.97Å | 1.00Å | |
| N08 | H23 | sing | 1.01Å | 1.00Å | |
| N26 | H25 | sing | 0.97Å | 1.00Å | |
| N26 | H26 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | C14 | C13 | 122.6° | 120.1° |
| C14 | C15 | C16 | 118.8° | 120.1° |
| C15 | C14 | H11 | 118.7° | 120.0° |
| C14 | C15 | H12 | 120.6° | 119.9° |
| C14 | C13 | C12 | 118.0° | 120.1° |
| C14 | C13 | H10 | 121.0° | 120.0° |
| C13 | C14 | H11 | 118.7° | 119.9° |
| C15 | C16 | O17 | 122.2° | 120.0° |
| C15 | C16 | C30 | 119.7° | 120.0° |
| C16 | C15 | H12 | 120.6° | 120.0° |
| N01 | C02 | C03 | 117.5° | 119.7° |
| N01 | C02 | N31 | 118.5° | 119.7° |
| C02 | N01 | H21 | 109.5° | 119.9° |
| C02 | N01 | H22 | 109.4° | 120.0° |
| C02 | C03 | C04 | 117.2° | 119.1° |
| C03 | C02 | N31 | 124.0° | 120.6° |
| C02 | C03 | H1 | 121.4° | 120.4° |
| C03 | C04 | C05 | 120.4° | 118.5° |
| C04 | C03 | H1 | 121.4° | 120.5° |
| C03 | C04 | H2 | 119.8° | 120.8° |
| C02 | N31 | C06 | 117.2° | 121.6° |
| C13 | C12 | C30 | 120.7° | 119.9° |
| C13 | C12 | O11 | 120.4° | 120.0° |
| C12 | C13 | H10 | 121.0° | 119.9° |
| C04 | C05 | C06 | 118.4° | 119.3° |
| C05 | C04 | H2 | 119.8° | 120.7° |
| C04 | C05 | H3 | 120.8° | 120.3° |
| O17 | C16 | C30 | 118.1° | 120.0° |
| C16 | O17 | C18 | 119.4° | 117.0° |
| C16 | C30 | C12 | 120.1° | 119.9° |
| C16 | C30 | H20 | 120.0° | 120.1° |
| N31 | C06 | C05 | 122.7° | 120.9° |
| N31 | C06 | C07 | 119.3° | 119.6° |
| O17 | C18 | C19 | 114.6° | 109.5° |
| O17 | C18 | H13 | 108.2° | 109.5° |
| O17 | C18 | H14 | 108.2° | 109.5° |
| C21 | C20 | C19 | 121.4° | 120.8° |
| C20 | C21 | C22 | 120.7° | 119.7° |
| C21 | C20 | H15 | 119.3° | 119.6° |
| C20 | C21 | H16 | 119.6° | 120.1° |
| C20 | C19 | C18 | 123.2° | 119.5° |
| C20 | C19 | C29 | 115.8° | 121.0° |
| C19 | C20 | H15 | 119.3° | 119.6° |
| C05 | C06 | C07 | 118.0° | 119.5° |
| C06 | C05 | H3 | 120.8° | 120.4° |
| C06 | C07 | N08 | 112.7° | 109.5° |
| C06 | C07 | H4 | 108.7° | 109.5° |
| C06 | C07 | H5 | 108.7° | 109.5° |
| C21 | C22 | C23 | 123.3° | 121.2° |
| C21 | C22 | C28 | 118.8° | 119.6° |
| C22 | C21 | H16 | 119.6° | 120.2° |
| C30 | C12 | O11 | 118.8° | 120.0° |
| C12 | C30 | H20 | 119.9° | 120.0° |
| C12 | O11 | C10 | 119.9° | 117.0° |
| C07 | N08 | C09 | 113.2° | 111.0° |
| N08 | C07 | H4 | 108.7° | 109.5° |
| N08 | C07 | H5 | 108.7° | 109.5° |
| C07 | N08 | H23 | 108.5° | 111.0° |
| N08 | C09 | C10 | 116.5° | 109.5° |
| N08 | C09 | H6 | 107.7° | 109.5° |
| N08 | C09 | H7 | 107.7° | 109.4° |
| C09 | N08 | H23 | 108.5° | 111.0° |
| C18 | C19 | C29 | 121.0° | 119.5° |
| C19 | C18 | H13 | 108.2° | 109.5° |
| C19 | C18 | H14 | 108.1° | 109.5° |
| C19 | C29 | C28 | 124.6° | 119.8° |
| C19 | C29 | H19 | 117.7° | 120.1° |
| O11 | C10 | C09 | 108.8° | 109.5° |
| O11 | C10 | H8 | 109.6° | 109.4° |
| O11 | C10 | H9 | 109.7° | 109.4° |
| C23 | C22 | C28 | 118.0° | 119.1° |
| C22 | C23 | C24 | 119.4° | 118.3° |
| C22 | C23 | H17 | 120.3° | 120.9° |
| C22 | C28 | C29 | 118.8° | 119.1° |
| C22 | C28 | N27 | 123.7° | 119.9° |
| C23 | C24 | C25 | 117.5° | 119.9° |
| C24 | C23 | H17 | 120.3° | 120.9° |
| C23 | C24 | H18 | 121.3° | 120.1° |
| C10 | C09 | H6 | 107.7° | 109.5° |
| C10 | C09 | H7 | 107.7° | 109.5° |
| C09 | C10 | H8 | 109.7° | 109.5° |
| C09 | C10 | H9 | 109.6° | 109.5° |
| C29 | C28 | N27 | 117.6° | 121.0° |
| C28 | C29 | H19 | 117.7° | 120.1° |
| C28 | N27 | C25 | 118.3° | 121.2° |
| C24 | C25 | N27 | 123.1° | 121.5° |
| C24 | C25 | N26 | 120.0° | 119.2° |
| C25 | C24 | H18 | 121.2° | 120.1° |
| N27 | C25 | N26 | 116.9° | 119.2° |
| C25 | N26 | H25 | 109.5° | 120.0° |
| C25 | N26 | H26 | 109.5° | 119.9° |
| H4 | C07 | H5 | 109.5° | 109.5° |
| H6 | C09 | H7 | 109.5° | 109.5° |
| H8 | C10 | H9 | 109.5° | 109.5° |
| H13 | C18 | H14 | 109.5° | 109.5° |
| H21 | N01 | H22 | 109.4° | 120.0° |
| H25 | N26 | H26 | 109.5° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C15 | C14 | C13 | H11 | 180.0° | 179.9° |
| C14 | C15 | C16 | H12 | 180.0° | 180.0° |
| C15 | C14 | C13 | C12 | 0.1° | 0.0° |
| C14 | C15 | C16 | O17 | 179.7° | 180.0° |
| C14 | C15 | C16 | C30 | 0.1° | 0.0° |
| C15 | C14 | C13 | H10 | 179.9° | 180.0° |
| C13 | C14 | C15 | C16 | 0.1° | 0.1° |
| C14 | C13 | C12 | H10 | 180.0° | 180.0° |
| C14 | C13 | C12 | C30 | 0.1° | 0.0° |
| C14 | C13 | C12 | O11 | 179.8° | 179.7° |
| C13 | C14 | C15 | H12 | 179.9° | 180.0° |
| C15 | C16 | O17 | C30 | 179.5° | 180.0° |
| C15 | C16 | O17 | C18 | 168.2° | 0.0° |
| C15 | C16 | C30 | C12 | 0.1° | 0.0° |
| C16 | C15 | C14 | H11 | 180.0° | 180.0° |
| C15 | C16 | C30 | H20 | 179.9° | 179.8° |
| N01 | C02 | C03 | N31 | 180.0° | 179.7° |
| N01 | C02 | C03 | C04 | 179.9° | 179.7° |
| N01 | C02 | N31 | C06 | 179.9° | 179.7° |
| N01 | C02 | C03 | H1 | 0.1° | 0.2° |
| C02 | N01 | H21 | H22 | 120.0° | 180.0° |
| C02 | C03 | C04 | H1 | 180.0° | 179.9° |
| C02 | C03 | C04 | C05 | 0.3° | 0.0° |
| C03 | C02 | N31 | C06 | 0.0° | 0.0° |
| C02 | C03 | C04 | H2 | 179.8° | 179.9° |
| C03 | C02 | N01 | H21 | 180.0° | 179.8° |
| C03 | C02 | N01 | H22 | 60.0° | 0.2° |
| C04 | C03 | C02 | N31 | 0.1° | 0.0° |
| C03 | C04 | C05 | H2 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 0.3° | 0.0° |
| C03 | C04 | C05 | H3 | 179.8° | 180.0° |
| C02 | N31 | C06 | C05 | 0.1° | 0.0° |
| C02 | N31 | C06 | C07 | 180.0° | 180.0° |
| N31 | C02 | C03 | H1 | 179.9° | 179.9° |
| N31 | C02 | N01 | H21 | 0.0° | 0.0° |
| N31 | C02 | N01 | H22 | 120.0° | 180.0° |
| C13 | C12 | C30 | C16 | 0.0° | 0.0° |
| C13 | C12 | C30 | O11 | 179.7° | 179.7° |
| C13 | C12 | O11 | C10 | 166.3° | 0.3° |
| C12 | C13 | C14 | H11 | 179.9° | 180.0° |
| C13 | C12 | C30 | H20 | 180.0° | 179.7° |
| C04 | C05 | C06 | N31 | 0.1° | 0.0° |
| C04 | C05 | C06 | H3 | 180.0° | 180.0° |
| C04 | C05 | C06 | C07 | 179.9° | 180.0° |
| C05 | C04 | C03 | H1 | 179.7° | 179.9° |
| O17 | C16 | C30 | C12 | 179.6° | 180.0° |
| C16 | O17 | C18 | C19 | 179.3° | 180.0° |
| O17 | C16 | C15 | H12 | 0.3° | 0.0° |
| C16 | O17 | C18 | H13 | 58.5° | 60.0° |
| C16 | O17 | C18 | H14 | 60.0° | 60.0° |
| O17 | C16 | C30 | H20 | 0.3° | 0.2° |
| C30 | C16 | O17 | C18 | 12.3° | 180.0° |
| C16 | C30 | C12 | H20 | 180.0° | 179.8° |
| C16 | C30 | C12 | O11 | 179.8° | 179.8° |
| C30 | C16 | C15 | H12 | 179.9° | 180.0° |
| N31 | C06 | C05 | C07 | 180.0° | 180.0° |
| N31 | C06 | C07 | N08 | 8.6° | 85.0° |
| N31 | C06 | C05 | H3 | 179.9° | 179.9° |
| N31 | C06 | C07 | H4 | 129.1° | 35.0° |
| N31 | C06 | C07 | H5 | 111.9° | 155.0° |
| O17 | C18 | C19 | C20 | 7.6° | 89.7° |
| O17 | C18 | C19 | H13 | 120.7° | 120.0° |
| O17 | C18 | C19 | H14 | 120.7° | 120.0° |
| O17 | C18 | C19 | C29 | 172.7° | 90.0° |
| O17 | C18 | H13 | H14 | 117.7° | 120.0° |
| C21 | C20 | C19 | H15 | 180.0° | 180.0° |
| C20 | C21 | C22 | H16 | 180.0° | 179.9° |
| C21 | C20 | C19 | C18 | 179.9° | 180.0° |
| C21 | C20 | C19 | C29 | 0.2° | 0.2° |
| C20 | C21 | C22 | C23 | 180.0° | 180.0° |
| C20 | C21 | C22 | C28 | 0.1° | 0.1° |
| C19 | C20 | C21 | C22 | 0.3° | 0.1° |
| C20 | C19 | C18 | C29 | 179.6° | 179.8° |
| C20 | C19 | C29 | C28 | 0.3° | 0.5° |
| C20 | C19 | C18 | H13 | 113.1° | 30.3° |
| C20 | C19 | C18 | H14 | 128.4° | 150.2° |
| C19 | C20 | C21 | H16 | 179.7° | 180.0° |
| C20 | C19 | C29 | H19 | 179.8° | 179.8° |
| C05 | C06 | C07 | N08 | 171.4° | 95.0° |
| C06 | C05 | C04 | H2 | 179.8° | 180.0° |
| C05 | C06 | C07 | H4 | 50.9° | 145.0° |
| C05 | C06 | C07 | H5 | 68.1° | 25.0° |
| C06 | C07 | N08 | H4 | 120.5° | 120.0° |
| C06 | C07 | N08 | H5 | 120.5° | 120.0° |
| C06 | C07 | N08 | C09 | 114.5° | 180.0° |
| C07 | C06 | C05 | H3 | 0.1° | 0.0° |
| C06 | C07 | H4 | H5 | 118.5° | 120.0° |
| C06 | C07 | N08 | H23 | 6.1° | 56.1° |
| C21 | C22 | C23 | C28 | 179.9° | 179.9° |
| C21 | C22 | C23 | C24 | 179.7° | 180.0° |
| C21 | C22 | C28 | C29 | 0.5° | 0.2° |
| C21 | C22 | C28 | N27 | 179.9° | 179.9° |
| C22 | C21 | C20 | H15 | 179.7° | 180.0° |
| C21 | C22 | C23 | H17 | 0.3° | 0.1° |
| C30 | C12 | O11 | C10 | 13.9° | 180.0° |
| C30 | C12 | C13 | H10 | 179.9° | 180.0° |
| C12 | O11 | C10 | C09 | 125.5° | 180.0° |
| C12 | O11 | C10 | H8 | 114.6° | 60.0° |
| C12 | O11 | C10 | H9 | 5.6° | 60.0° |
| O11 | C12 | C13 | H10 | 0.1° | 0.3° |
| O11 | C12 | C30 | H20 | 0.2° | 0.0° |
| C07 | N08 | C09 | H23 | 120.5° | 124.0° |
| C07 | N08 | C09 | C10 | 124.6° | 180.0° |
| N08 | C07 | H4 | H5 | 118.5° | 120.0° |
| C07 | N08 | C09 | H6 | 3.6° | 60.0° |
| C07 | N08 | C09 | H7 | 114.4° | 60.0° |
| N08 | C09 | C10 | O11 | 75.1° | 65.0° |
| N08 | C09 | C10 | H6 | 121.0° | 120.0° |
| N08 | C09 | C10 | H7 | 121.0° | 120.0° |
| C09 | N08 | C07 | H4 | 125.0° | 60.0° |
| C09 | N08 | C07 | H5 | 6.0° | 60.0° |
| N08 | C09 | H6 | H7 | 116.8° | 119.9° |
| N08 | C09 | C10 | H8 | 165.1° | 175.1° |
| N08 | C09 | C10 | H9 | 44.9° | 55.0° |
| C18 | C19 | C29 | C28 | 179.4° | 179.8° |
| C19 | C18 | H13 | H14 | 117.6° | 120.0° |
| C18 | C19 | C20 | H15 | 0.1° | 0.0° |
| C18 | C19 | C29 | H19 | 0.6° | 0.0° |
| C19 | C29 | C28 | C22 | 0.6° | 0.4° |
| C19 | C29 | C28 | H19 | 180.0° | 179.7° |
| C19 | C29 | C28 | N27 | 179.7° | 179.8° |
| C29 | C19 | C18 | H13 | 66.5° | 150.0° |
| C29 | C19 | C18 | H14 | 52.0° | 30.0° |
| C29 | C19 | C20 | H15 | 179.8° | 179.7° |
| O11 | C10 | C09 | H8 | 119.9° | 119.9° |
| O11 | C10 | C09 | H9 | 119.9° | 120.0° |
| O11 | C10 | C09 | H6 | 163.9° | 175.0° |
| O11 | C10 | C09 | H7 | 45.9° | 55.0° |
| O11 | C10 | H8 | H9 | 120.3° | 120.0° |
| C22 | C23 | C24 | H17 | 180.0° | 179.9° |
| C23 | C22 | C28 | C29 | 179.6° | 179.7° |
| C23 | C22 | C28 | N27 | 0.0° | 0.0° |
| C22 | C23 | C24 | C25 | 0.5° | 0.0° |
| C23 | C22 | C21 | H16 | 0.0° | 0.1° |
| C22 | C23 | C24 | H18 | 179.6° | 179.9° |
| C28 | C22 | C23 | C24 | 0.4° | 0.0° |
| C22 | C28 | C29 | N27 | 179.6° | 179.7° |
| C22 | C28 | N27 | C25 | 0.4° | 0.0° |
| C28 | C22 | C21 | H16 | 179.9° | 180.0° |
| C28 | C22 | C23 | H17 | 179.6° | 180.0° |
| C22 | C28 | C29 | H19 | 179.4° | 179.8° |
| C23 | C24 | C25 | H18 | 180.0° | 180.0° |
| C23 | C24 | C25 | N27 | 0.1° | 0.0° |
| C23 | C24 | C25 | N26 | 179.9° | 180.0° |
| C10 | C09 | H6 | H7 | 116.8° | 120.0° |
| C09 | C10 | H8 | H9 | 120.3° | 120.1° |
| C10 | C09 | N08 | H23 | 114.9° | 56.0° |
| C29 | C28 | N27 | C25 | 179.2° | 179.8° |
| C28 | N27 | C25 | C24 | 0.3° | 0.0° |
| C28 | N27 | C25 | N26 | 179.4° | 179.9° |
| N27 | C28 | C29 | H19 | 0.3° | 0.1° |
| C24 | C25 | N27 | N26 | 179.8° | 180.0° |
| C25 | C24 | C23 | H17 | 179.5° | 180.0° |
| C24 | C25 | N26 | H25 | 179.8° | 0.0° |
| C24 | C25 | N26 | H26 | 59.8° | 180.0° |
| N27 | C25 | C24 | H18 | 179.9° | 180.0° |
| N27 | C25 | N26 | H25 | 0.0° | 180.0° |
| N27 | C25 | N26 | H26 | 120.0° | 0.0° |
| N26 | C25 | C24 | H18 | 0.2° | 0.0° |
| C25 | N26 | H25 | H26 | 120.0° | 180.0° |
| H1 | C03 | C04 | H2 | 0.2° | 0.0° |
| H2 | C04 | C05 | H3 | 0.2° | 0.0° |
| H4 | C07 | N08 | H23 | 114.4° | 176.0° |
| H5 | C07 | N08 | H23 | 126.5° | 64.0° |
| H6 | C09 | C10 | H8 | 44.1° | 55.0° |
| H6 | C09 | C10 | H9 | 76.1° | 65.0° |
| H6 | C09 | N08 | H23 | 124.1° | 64.0° |
| H7 | C09 | C10 | H8 | 73.9° | 65.0° |
| H7 | C09 | C10 | H9 | 165.9° | 174.9° |
| H7 | C09 | N08 | H23 | 6.1° | 176.0° |
| H10 | C13 | C14 | H11 | 0.1° | 0.0° |
| H11 | C14 | C15 | H12 | 0.1° | 0.1° |
| H15 | C20 | C21 | H16 | 0.3° | 0.0° |
| H17 | C23 | C24 | H18 | 0.4° | 0.0° |
