V5Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O31 | C30 | sing | 1.36Å | 1.40Å | |
| C01 | O02 | sing | 1.43Å | 1.40Å | |
| O28 | C29 | sing | 1.43Å | 1.40Å | |
| O28 | C27 | sing | 1.36Å | 1.40Å | |
| C30 | C27 | doub | 1.39Å | 1.39Å | Aromatic |
| C30 | C03 | sing | 1.39Å | 1.39Å | Aromatic |
| O02 | C03 | sing | 1.36Å | 1.40Å | |
| C27 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C03 | C04 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C05 | doub | 1.40Å | 1.39Å | Aromatic |
| C04 | C05 | sing | 1.40Å | 1.39Å | Aromatic |
| C05 | C06 | sing | 1.46Å | 1.55Å | |
| C06 | C07 | doub | 1.38Å | 1.33Å | |
| N08 | C07 | sing | 1.36Å | 1.32Å | |
| N08 | C09 | doub | 1.31Å | 1.34Å | |
| C07 | C24 | sing | 1.47Å | 1.38Å | |
| O12 | N11 | sing | 1.42Å | 1.41Å | |
| N11 | C10 | doub | 1.29Å | 1.25Å | |
| C09 | C10 | sing | 1.47Å | 1.53Å | |
| C09 | N13 | sing | 1.38Å | 1.34Å | |
| C24 | O25 | doub | 1.22Å | 1.18Å | |
| C24 | N13 | sing | 1.35Å | 1.32Å | |
| N13 | C14 | sing | 1.40Å | 1.35Å | |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C14 | C23 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | N18 | sing | 1.40Å | 1.47Å | |
| N18 | C19 | sing | 1.47Å | 1.45Å | |
| N18 | C20 | sing | 1.47Å | 1.45Å | |
| N18 | C21 | sing | 1.47Å | 1.46Å | |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C04 | H4 | sing | 1.08Å | 1.08Å | |
| C06 | H6 | sing | 1.08Å | 1.08Å | |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C15 | H9 | sing | 1.08Å | 1.08Å | |
| C16 | H10 | sing | 1.08Å | 1.08Å | |
| C19 | H11 | sing | 1.09Å | 1.10Å | |
| C19 | H12 | sing | 1.09Å | 1.10Å | |
| C19 | H13 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.09Å | 1.10Å | |
| C20 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H16 | sing | 1.09Å | 1.10Å | |
| C21 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.08Å | 1.08Å | |
| C26 | H22 | sing | 1.08Å | 1.08Å | |
| C29 | H23 | sing | 1.09Å | 1.10Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| O12 | H26 | sing | 0.97Å | 0.95Å | |
| O31 | H27 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O31 | C30 | C27 | 120.1° | 119.9° |
| O31 | C30 | C03 | 120.0° | 119.9° |
| C30 | O31 | H27 | 109.5° | 114.0° |
| C01 | O02 | C03 | 113.6° | 117.0° |
| O02 | C01 | H1 | 109.5° | 109.5° |
| O02 | C01 | H2 | 109.5° | 109.5° |
| O02 | C01 | H3 | 109.5° | 109.5° |
| C29 | O28 | C27 | 114.6° | 117.0° |
| O28 | C29 | H23 | 109.5° | 109.5° |
| O28 | C29 | H24 | 109.5° | 109.5° |
| O28 | C29 | H25 | 109.5° | 109.5° |
| O28 | C27 | C30 | 119.7° | 119.9° |
| O28 | C27 | C26 | 120.5° | 119.9° |
| C27 | C30 | C03 | 119.8° | 120.2° |
| C30 | C27 | C26 | 119.8° | 120.1° |
| C30 | C03 | O02 | 119.7° | 119.9° |
| C30 | C03 | C04 | 120.2° | 120.1° |
| O02 | C03 | C04 | 120.1° | 119.9° |
| C27 | C26 | C05 | 120.7° | 119.9° |
| C27 | C26 | H22 | 119.7° | 120.1° |
| C03 | C04 | C05 | 120.3° | 119.9° |
| C03 | C04 | H4 | 119.9° | 120.0° |
| C26 | C05 | C04 | 119.2° | 119.8° |
| C26 | C05 | C06 | 118.4° | 120.1° |
| C05 | C26 | H22 | 119.7° | 120.1° |
| C04 | C05 | C06 | 122.4° | 120.1° |
| C05 | C04 | H4 | 119.9° | 120.1° |
| C05 | C06 | C07 | 125.8° | 120.0° |
| C05 | C06 | H6 | 117.1° | 120.0° |
| C06 | C07 | N08 | 128.3° | 126.9° |
| C06 | C07 | C24 | 124.8° | 127.0° |
| C07 | C06 | H6 | 117.1° | 120.0° |
| C07 | N08 | C09 | 108.4° | 109.4° |
| N08 | C07 | C24 | 106.9° | 106.1° |
| N08 | C09 | C10 | 125.6° | 124.6° |
| N08 | C09 | N13 | 109.0° | 110.8° |
| C07 | C24 | O25 | 126.0° | 127.3° |
| C07 | C24 | N13 | 108.0° | 105.5° |
| O12 | N11 | C10 | 120.6° | 120.0° |
| N11 | O12 | H26 | 109.5° | 114.0° |
| N11 | C10 | C09 | 121.0° | 120.0° |
| N11 | C10 | H8 | 119.5° | 120.0° |
| C10 | C09 | N13 | 125.4° | 124.6° |
| C09 | C10 | H8 | 119.5° | 120.0° |
| C09 | N13 | C24 | 107.7° | 108.1° |
| C09 | N13 | C14 | 126.3° | 125.9° |
| O25 | C24 | N13 | 126.1° | 127.2° |
| C24 | N13 | C14 | 126.0° | 125.9° |
| N13 | C14 | C15 | 120.2° | 120.1° |
| N13 | C14 | C23 | 120.1° | 120.0° |
| C15 | C14 | C23 | 119.7° | 119.9° |
| C14 | C15 | C16 | 120.0° | 119.9° |
| C14 | C15 | H9 | 120.0° | 120.1° |
| C14 | C23 | C22 | 120.3° | 119.9° |
| C14 | C23 | H21 | 119.9° | 120.1° |
| C15 | C16 | C17 | 120.2° | 120.1° |
| C16 | C15 | H9 | 120.0° | 120.0° |
| C15 | C16 | H10 | 119.9° | 120.0° |
| C23 | C22 | C17 | 120.0° | 120.1° |
| C23 | C22 | H20 | 120.0° | 120.0° |
| C22 | C23 | H21 | 119.8° | 120.0° |
| C16 | C17 | C22 | 119.7° | 120.1° |
| C16 | C17 | N18 | 120.9° | 119.9° |
| C17 | C16 | H10 | 119.9° | 120.0° |
| C22 | C17 | N18 | 119.4° | 120.0° |
| C17 | C22 | H20 | 120.0° | 119.9° |
| C17 | N18 | C19 | 110.5° | 109.5° |
| C17 | N18 | C20 | 109.3° | 109.5° |
| C17 | N18 | C21 | 109.2° | 109.4° |
| C19 | N18 | C20 | 109.3° | 109.5° |
| C19 | N18 | C21 | 109.3° | 109.5° |
| N18 | C19 | H11 | 109.5° | 109.5° |
| N18 | C19 | H12 | 109.5° | 109.5° |
| N18 | C19 | H13 | 109.5° | 109.5° |
| C20 | N18 | C21 | 109.2° | 109.5° |
| N18 | C20 | H14 | 109.5° | 109.5° |
| N18 | C20 | H15 | 109.5° | 109.5° |
| N18 | C20 | H16 | 109.5° | 109.5° |
| N18 | C21 | H17 | 109.5° | 109.5° |
| N18 | C21 | H18 | 109.5° | 109.5° |
| N18 | C21 | H19 | 109.5° | 109.5° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.4° |
| H11 | C19 | H12 | 109.5° | 109.4° |
| H11 | C19 | H13 | 109.5° | 109.5° |
| H12 | C19 | H13 | 109.5° | 109.5° |
| H14 | C20 | H15 | 109.5° | 109.5° |
| H14 | C20 | H16 | 109.5° | 109.5° |
| H15 | C20 | H16 | 109.5° | 109.5° |
| H17 | C21 | H18 | 109.5° | 109.5° |
| H17 | C21 | H19 | 109.4° | 109.4° |
| H18 | C21 | H19 | 109.4° | 109.4° |
| H23 | C29 | H24 | 109.5° | 109.4° |
| H23 | C29 | H25 | 109.4° | 109.5° |
| H24 | C29 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O31 | C30 | C27 | O28 | 0.0° | 0.0° |
| O31 | C30 | C27 | C03 | 179.9° | 180.0° |
| O31 | C30 | C03 | O02 | 0.0° | 0.3° |
| O31 | C30 | C27 | C26 | 180.0° | 180.0° |
| O31 | C30 | C03 | C04 | 180.0° | 180.0° |
| C01 | O02 | C03 | C30 | 99.6° | 179.7° |
| C01 | O02 | C03 | C04 | 80.4° | 0.0° |
| O02 | C01 | H1 | H2 | 120.0° | 120.0° |
| O02 | C01 | H1 | H3 | 120.0° | 120.1° |
| O02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C29 | O28 | C27 | C30 | 152.8° | 175.0° |
| C29 | O28 | C27 | C26 | 27.2° | 4.9° |
| O28 | C29 | H23 | H24 | 120.0° | 120.0° |
| O28 | C29 | H23 | H25 | 120.0° | 120.1° |
| O28 | C29 | H24 | H25 | 120.0° | 120.0° |
| O28 | C27 | C30 | C26 | 180.0° | 179.9° |
| O28 | C27 | C30 | C03 | 179.9° | 180.0° |
| O28 | C27 | C26 | C05 | 179.9° | 180.0° |
| O28 | C27 | C26 | H22 | 0.2° | 0.1° |
| C27 | O28 | C29 | H23 | 180.0° | 56.6° |
| C27 | O28 | C29 | H24 | 60.0° | 63.3° |
| C27 | O28 | C29 | H25 | 60.0° | 176.7° |
| C27 | C30 | C03 | O02 | 179.9° | 179.7° |
| C27 | C30 | C03 | C04 | 0.1° | 0.0° |
| C30 | C27 | C26 | C05 | 0.2° | 0.0° |
| C30 | C27 | C26 | H22 | 179.8° | 180.0° |
| C27 | C30 | O31 | H27 | 180.0° | 90.0° |
| C30 | C03 | O02 | C04 | 180.0° | 179.7° |
| C03 | C30 | C27 | C26 | 0.1° | 0.0° |
| C30 | C03 | C04 | C05 | 0.2° | 0.0° |
| C30 | C03 | C04 | H4 | 179.8° | 180.0° |
| C03 | C30 | O31 | H27 | 0.1° | 90.0° |
| O02 | C03 | C04 | C05 | 179.8° | 179.7° |
| C03 | O02 | C01 | H1 | 180.0° | 60.0° |
| C03 | O02 | C01 | H2 | 60.0° | 180.0° |
| C03 | O02 | C01 | H3 | 60.0° | 60.0° |
| O02 | C03 | C04 | H4 | 0.2° | 0.3° |
| C27 | C26 | C05 | H22 | 180.0° | 179.9° |
| C27 | C26 | C05 | C04 | 0.3° | 0.0° |
| C27 | C26 | C05 | C06 | 179.9° | 180.0° |
| C03 | C04 | C05 | C26 | 0.3° | 0.0° |
| C03 | C04 | C05 | H4 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 179.9° | 180.0° |
| C26 | C05 | C04 | C06 | 179.8° | 180.0° |
| C26 | C05 | C06 | C07 | 167.7° | 152.8° |
| C26 | C05 | C04 | H4 | 179.7° | 180.0° |
| C26 | C05 | C06 | H6 | 12.3° | 27.1° |
| C04 | C05 | C06 | C07 | 12.2° | 27.2° |
| C04 | C05 | C06 | H6 | 167.8° | 152.9° |
| C04 | C05 | C26 | H22 | 179.7° | 179.9° |
| C05 | C06 | C07 | H6 | 180.0° | 179.9° |
| C05 | C06 | C07 | N08 | 19.0° | 7.9° |
| C05 | C06 | C07 | C24 | 162.1° | 172.4° |
| C06 | C05 | C04 | H4 | 0.1° | 0.0° |
| C06 | C05 | C26 | H22 | 0.1° | 0.1° |
| C06 | C07 | N08 | C24 | 179.1° | 179.7° |
| C06 | C07 | N08 | C09 | 179.4° | 180.0° |
| C06 | C07 | C24 | O25 | 0.6° | 0.1° |
| C06 | C07 | C24 | N13 | 179.5° | 180.0° |
| C07 | N08 | C09 | C10 | 179.6° | 179.8° |
| C07 | N08 | C09 | N13 | 0.2° | 0.2° |
| N08 | C07 | C24 | O25 | 179.7° | 179.8° |
| N08 | C07 | C24 | N13 | 0.4° | 0.2° |
| N08 | C07 | C06 | H6 | 161.0° | 172.0° |
| C09 | N08 | C07 | C24 | 0.4° | 0.3° |
| N08 | C09 | C10 | N11 | 43.9° | 6.4° |
| N08 | C09 | C10 | N13 | 179.7° | 179.9° |
| N08 | C09 | N13 | C24 | 0.1° | 0.1° |
| N08 | C09 | N13 | C14 | 179.9° | 180.0° |
| N08 | C09 | C10 | H8 | 136.1° | 173.6° |
| C07 | C24 | N13 | C09 | 0.3° | 0.1° |
| C07 | C24 | O25 | N13 | 179.8° | 180.0° |
| C07 | C24 | N13 | C14 | 179.9° | 179.8° |
| C24 | C07 | C06 | H6 | 17.9° | 7.7° |
| O12 | N11 | C10 | C09 | 0.3° | 6.8° |
| O12 | N11 | C10 | H8 | 179.6° | 173.2° |
| N11 | C10 | C09 | H8 | 180.0° | 180.0° |
| N11 | C10 | C09 | N13 | 135.8° | 173.5° |
| C10 | N11 | O12 | H26 | 180.0° | 174.8° |
| C10 | C09 | N13 | C24 | 179.8° | 180.0° |
| C10 | C09 | N13 | C14 | 0.4° | 0.1° |
| C09 | N13 | C24 | O25 | 179.8° | 179.9° |
| C09 | N13 | C24 | C14 | 179.8° | 179.9° |
| C09 | N13 | C14 | C15 | 109.1° | 61.6° |
| C09 | N13 | C14 | C23 | 70.8° | 118.1° |
| N13 | C09 | C10 | H8 | 44.2° | 6.5° |
| O25 | C24 | N13 | C14 | 0.1° | 0.1° |
| C24 | N13 | C14 | C15 | 70.6° | 118.5° |
| C24 | N13 | C14 | C23 | 109.5° | 61.8° |
| N13 | C14 | C15 | C23 | 180.0° | 179.7° |
| N13 | C14 | C15 | C16 | 179.9° | 179.7° |
| N13 | C14 | C23 | C22 | 180.0° | 179.8° |
| N13 | C14 | C15 | H9 | 0.1° | 0.3° |
| N13 | C14 | C23 | H21 | 0.0° | 0.3° |
| C14 | C15 | C16 | H9 | 180.0° | 179.9° |
| C15 | C14 | C23 | C22 | 0.0° | 0.1° |
| C14 | C15 | C16 | C17 | 0.1° | 0.0° |
| C14 | C15 | C16 | H10 | 179.9° | 180.0° |
| C15 | C14 | C23 | H21 | 180.0° | 180.0° |
| C23 | C14 | C15 | C16 | 0.1° | 0.1° |
| C14 | C23 | C22 | H21 | 180.0° | 179.9° |
| C14 | C23 | C22 | C17 | 0.0° | 0.1° |
| C23 | C14 | C15 | H9 | 179.9° | 180.0° |
| C14 | C23 | C22 | H20 | 180.0° | 180.0° |
| C15 | C16 | C17 | H10 | 180.0° | 180.0° |
| C15 | C16 | C17 | C22 | 0.1° | 0.0° |
| C15 | C16 | C17 | N18 | 179.9° | 180.0° |
| C23 | C22 | C17 | C16 | 0.0° | 0.0° |
| C23 | C22 | C17 | H20 | 180.0° | 180.0° |
| C23 | C22 | C17 | N18 | 180.0° | 179.9° |
| C16 | C17 | C22 | N18 | 180.0° | 180.0° |
| C16 | C17 | N18 | C19 | 3.5° | 60.0° |
| C16 | C17 | N18 | C20 | 116.8° | 180.0° |
| C16 | C17 | N18 | C21 | 123.8° | 60.0° |
| C17 | C16 | C15 | H9 | 179.9° | 179.9° |
| C16 | C17 | C22 | H20 | 180.0° | 180.0° |
| C22 | C17 | N18 | C19 | 176.5° | 120.0° |
| C22 | C17 | N18 | C20 | 63.2° | 0.0° |
| C22 | C17 | N18 | C21 | 56.2° | 120.0° |
| C22 | C17 | C16 | H10 | 179.9° | 180.0° |
| C17 | C22 | C23 | H21 | 180.0° | 180.0° |
| C17 | N18 | C19 | C20 | 120.3° | 120.0° |
| C17 | N18 | C19 | C21 | 120.3° | 120.0° |
| C17 | N18 | C20 | C21 | 119.4° | 120.0° |
| N18 | C17 | C16 | H10 | 0.1° | 0.0° |
| C17 | N18 | C19 | H11 | 180.0° | 60.1° |
| C17 | N18 | C19 | H12 | 60.0° | 180.0° |
| C17 | N18 | C19 | H13 | 60.0° | 60.0° |
| C17 | N18 | C20 | H14 | 180.0° | 59.9° |
| C17 | N18 | C20 | H15 | 60.0° | 179.9° |
| C17 | N18 | C20 | H16 | 60.0° | 60.0° |
| C17 | N18 | C21 | H17 | 180.0° | 60.0° |
| C17 | N18 | C21 | H18 | 60.0° | 179.9° |
| C17 | N18 | C21 | H19 | 60.0° | 60.0° |
| N18 | C17 | C22 | H20 | 0.0° | 0.0° |
| C19 | N18 | C20 | C21 | 119.5° | 120.0° |
| N18 | C19 | H11 | H12 | 120.0° | 120.0° |
| N18 | C19 | H11 | H13 | 120.0° | 120.1° |
| N18 | C19 | H12 | H13 | 120.0° | 120.0° |
| C19 | N18 | C20 | H14 | 58.9° | 180.0° |
| C19 | N18 | C20 | H15 | 178.9° | 60.0° |
| C19 | N18 | C20 | H16 | 61.1° | 60.0° |
| C19 | N18 | C21 | H17 | 58.9° | 60.0° |
| C19 | N18 | C21 | H18 | 61.1° | 60.0° |
| C19 | N18 | C21 | H19 | 179.0° | 180.0° |
| C20 | N18 | C19 | H11 | 59.7° | 59.9° |
| C20 | N18 | C19 | H12 | 60.4° | 60.0° |
| C20 | N18 | C19 | H13 | 179.7° | 180.0° |
| N18 | C20 | H14 | H15 | 120.0° | 120.0° |
| N18 | C20 | H14 | H16 | 120.0° | 120.0° |
| N18 | C20 | H15 | H16 | 120.0° | 120.0° |
| C20 | N18 | C21 | H17 | 60.6° | 180.0° |
| C20 | N18 | C21 | H18 | 179.4° | 60.0° |
| C20 | N18 | C21 | H19 | 59.5° | 60.0° |
| C21 | N18 | C19 | H11 | 59.7° | 179.9° |
| C21 | N18 | C19 | H12 | 179.8° | 60.0° |
| C21 | N18 | C19 | H13 | 60.3° | 60.0° |
| C21 | N18 | C20 | H14 | 60.6° | 60.0° |
| C21 | N18 | C20 | H15 | 59.4° | 60.0° |
| C21 | N18 | C20 | H16 | 179.4° | 180.0° |
| N18 | C21 | H17 | H18 | 120.0° | 120.0° |
| N18 | C21 | H17 | H19 | 120.0° | 120.0° |
| N18 | C21 | H18 | H19 | 120.0° | 120.0° |
| H1 | C01 | H2 | H3 | 120.0° | 119.9° |
| H9 | C15 | C16 | H10 | 0.1° | 0.1° |
| H11 | C19 | H12 | H13 | 120.0° | 120.0° |
| H14 | C20 | H15 | H16 | 120.0° | 120.0° |
| H17 | C21 | H18 | H19 | 120.0° | 119.9° |
| H20 | C22 | C23 | H21 | 0.0° | 0.0° |
| H23 | C29 | H24 | H25 | 120.0° | 120.0° |
