RNV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C22 | C23 | sing | 1.53Å | 1.56Å | |
| C22 | C21 | sing | 1.52Å | 1.55Å | |
| C23 | C24 | sing | 1.53Å | 1.55Å | |
| C24 | C25 | sing | 1.54Å | 1.53Å | |
| C21 | S26 | sing | 1.76Å | 1.69Å | Aromatic |
| C21 | C20 | doub | 1.33Å | 1.41Å | Aromatic |
| S26 | C18 | sing | 1.76Å | 1.66Å | Aromatic |
| C20 | C25 | sing | 1.52Å | 1.51Å | |
| C20 | C19 | sing | 1.46Å | 1.53Å | Aromatic |
| C18 | C19 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | N17 | sing | 1.34Å | 1.34Å | Aromatic |
| C19 | C02 | sing | 1.42Å | 1.42Å | Aromatic |
| N17 | C04 | doub | 1.32Å | 1.33Å | Aromatic |
| C02 | N01 | sing | 1.38Å | 1.45Å | |
| C02 | N03 | doub | 1.32Å | 1.32Å | Aromatic |
| C04 | N03 | sing | 1.33Å | 1.33Å | Aromatic |
| C04 | S05 | sing | 1.76Å | 1.82Å | |
| S05 | C06 | sing | 1.81Å | 1.84Å | |
| C06 | C07 | sing | 1.51Å | 1.55Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C14 | N11 | sing | 1.47Å | 1.47Å | |
| C07 | N08 | sing | 1.35Å | 1.47Å | |
| C07 | O16 | doub | 1.21Å | 1.18Å | |
| N08 | C09 | sing | 1.46Å | 1.48Å | |
| N11 | C10 | sing | 1.47Å | 1.47Å | |
| N11 | C12 | sing | 1.47Å | 1.47Å | |
| C10 | C09 | sing | 1.53Å | 1.54Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| N01 | H5 | sing | 0.97Å | 1.00Å | |
| N01 | H6 | sing | 0.97Å | 1.00Å | |
| C06 | H7 | sing | 1.09Å | 1.10Å | |
| C06 | H8 | sing | 1.09Å | 1.10Å | |
| N08 | H9 | sing | 0.97Å | 1.00Å | |
| C09 | H10 | sing | 1.09Å | 1.10Å | |
| C09 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H25 | sing | 1.09Å | 1.10Å | |
| C24 | H26 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C23 | C22 | C21 | 113.6° | 108.8° |
| C22 | C23 | C24 | 114.5° | 109.0° |
| C23 | C22 | H21 | 108.4° | 109.6° |
| C23 | C22 | H22 | 108.4° | 109.6° |
| C22 | C23 | H23 | 108.2° | 109.6° |
| C22 | C23 | H24 | 108.2° | 109.6° |
| C22 | C21 | S26 | 127.0° | 124.3° |
| C22 | C21 | C20 | 122.6° | 124.3° |
| C21 | C22 | H21 | 108.4° | 109.6° |
| C21 | C22 | H22 | 108.4° | 109.5° |
| C23 | C24 | C25 | 111.8° | 108.2° |
| C24 | C23 | H23 | 108.2° | 109.5° |
| C24 | C23 | H24 | 108.2° | 109.5° |
| C23 | C24 | H25 | 108.9° | 109.5° |
| C23 | C24 | H26 | 108.9° | 109.5° |
| C24 | C25 | C20 | 110.2° | 108.5° |
| C25 | C24 | H25 | 108.9° | 110.7° |
| C25 | C24 | H26 | 108.9° | 109.2° |
| C24 | C25 | H27 | 109.3° | 110.6° |
| C24 | C25 | H28 | 109.3° | 108.9° |
| S26 | C21 | C20 | 110.4° | 111.4° |
| C21 | S26 | C18 | 98.2° | 92.5° |
| C21 | C20 | C25 | 121.8° | 123.4° |
| C21 | C20 | C19 | 109.0° | 113.9° |
| S26 | C18 | C19 | 109.4° | 109.6° |
| S26 | C18 | N17 | 132.3° | 131.1° |
| C25 | C20 | C19 | 129.2° | 122.7° |
| C20 | C25 | H27 | 109.3° | 109.6° |
| C20 | C25 | H28 | 109.3° | 109.6° |
| C20 | C19 | C18 | 113.0° | 112.7° |
| C20 | C19 | C02 | 128.1° | 129.5° |
| C19 | C18 | N17 | 118.3° | 119.3° |
| C18 | C19 | C02 | 118.9° | 117.8° |
| C18 | N17 | C04 | 120.5° | 120.9° |
| C19 | C02 | N01 | 123.7° | 120.5° |
| C19 | C02 | N03 | 118.7° | 119.0° |
| N17 | C04 | N03 | 123.2° | 122.0° |
| N17 | C04 | S05 | 118.9° | 119.0° |
| N01 | C02 | N03 | 117.5° | 120.5° |
| C02 | N01 | H5 | 109.5° | 120.0° |
| C02 | N01 | H6 | 109.5° | 120.0° |
| C02 | N03 | C04 | 120.3° | 121.1° |
| N03 | C04 | S05 | 117.9° | 119.0° |
| C04 | S05 | C06 | 107.6° | 100.0° |
| S05 | C06 | C07 | 108.8° | 109.5° |
| S05 | C06 | H7 | 109.6° | 109.5° |
| S05 | C06 | H8 | 109.7° | 109.5° |
| C06 | C07 | N08 | 121.9° | 120.0° |
| C06 | C07 | O16 | 119.1° | 120.0° |
| C07 | C06 | H7 | 109.7° | 109.5° |
| C07 | C06 | H8 | 109.7° | 109.4° |
| C15 | C14 | N11 | 111.1° | 109.5° |
| C15 | C14 | H16 | 109.1° | 109.5° |
| C15 | C14 | H17 | 109.1° | 109.5° |
| C14 | C15 | H18 | 109.5° | 109.5° |
| C14 | C15 | H19 | 109.5° | 109.5° |
| C14 | C15 | H20 | 109.4° | 109.5° |
| C14 | N11 | C10 | 111.4° | 111.0° |
| C14 | N11 | C12 | 111.0° | 111.0° |
| N11 | C14 | H16 | 109.0° | 109.4° |
| N11 | C14 | H17 | 109.1° | 109.5° |
| N08 | C07 | O16 | 119.1° | 120.0° |
| C07 | N08 | C09 | 119.0° | 120.0° |
| C07 | N08 | H9 | 120.5° | 120.0° |
| N08 | C09 | C10 | 110.8° | 109.5° |
| C09 | N08 | H9 | 120.5° | 120.0° |
| N08 | C09 | H10 | 109.1° | 109.5° |
| N08 | C09 | H11 | 109.2° | 109.4° |
| C10 | N11 | C12 | 110.8° | 111.0° |
| N11 | C10 | C09 | 112.8° | 109.5° |
| N11 | C10 | H1 | 108.6° | 109.4° |
| N11 | C10 | H2 | 108.6° | 109.5° |
| N11 | C12 | C13 | 115.1° | 109.5° |
| N11 | C12 | H3 | 108.1° | 109.5° |
| N11 | C12 | H4 | 108.0° | 109.4° |
| C09 | C10 | H1 | 108.7° | 109.4° |
| C09 | C10 | H2 | 108.7° | 109.5° |
| C10 | C09 | H10 | 109.1° | 109.5° |
| C10 | C09 | H11 | 109.1° | 109.4° |
| C13 | C12 | H3 | 108.0° | 109.5° |
| C13 | C12 | H4 | 108.1° | 109.5° |
| C12 | C13 | H13 | 109.5° | 109.4° |
| C12 | C13 | H14 | 109.5° | 109.5° |
| C12 | C13 | H15 | 109.5° | 109.5° |
| H1 | C10 | H2 | 109.4° | 109.5° |
| H3 | C12 | H4 | 109.4° | 109.5° |
| H5 | N01 | H6 | 109.4° | 120.0° |
| H7 | C06 | H8 | 109.4° | 109.5° |
| H10 | C09 | H11 | 109.5° | 109.4° |
| H13 | C13 | H14 | 109.4° | 109.5° |
| H13 | C13 | H15 | 109.4° | 109.5° |
| H14 | C13 | H15 | 109.5° | 109.4° |
| H16 | C14 | H17 | 109.5° | 109.5° |
| H18 | C15 | H19 | 109.4° | 109.5° |
| H18 | C15 | H20 | 109.5° | 109.4° |
| H19 | C15 | H20 | 109.5° | 109.5° |
| H21 | C22 | H22 | 109.5° | 109.7° |
| H23 | C23 | H24 | 109.5° | 109.6° |
| H25 | C24 | H26 | 109.5° | 109.6° |
| H27 | C25 | H28 | 109.5° | 109.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C23 | C22 | C21 | H21 | 120.6° | 119.8° |
| C23 | C22 | C21 | H22 | 120.6° | 119.8° |
| C22 | C23 | C24 | H23 | 120.7° | 119.8° |
| C22 | C23 | C24 | H24 | 120.7° | 119.9° |
| C22 | C23 | C24 | C25 | 53.8° | 71.3° |
| C23 | C22 | C21 | S26 | 175.9° | 163.4° |
| C23 | C22 | C21 | C20 | 4.0° | 15.8° |
| C23 | C22 | H21 | H22 | 118.1° | 120.3° |
| C22 | C23 | H23 | H24 | 117.7° | 120.3° |
| C22 | C23 | C24 | H25 | 174.1° | 49.5° |
| C22 | C23 | C24 | H26 | 66.6° | 169.7° |
| C21 | C22 | C23 | C24 | 22.7° | 50.0° |
| C22 | C21 | S26 | C20 | 179.9° | 179.3° |
| C22 | C21 | S26 | C18 | 179.5° | 179.8° |
| C22 | C21 | C20 | C25 | 0.1° | 0.1° |
| C22 | C21 | C20 | C19 | 179.5° | 180.0° |
| C21 | C22 | H21 | H22 | 118.1° | 120.3° |
| C21 | C22 | C23 | H23 | 98.0° | 169.8° |
| C21 | C22 | C23 | H24 | 143.4° | 69.8° |
| C23 | C24 | C25 | H25 | 120.4° | 120.0° |
| C23 | C24 | C25 | H26 | 120.3° | 119.2° |
| C23 | C24 | C25 | C20 | 55.9° | 52.1° |
| C24 | C23 | C22 | H21 | 97.9° | 69.8° |
| C24 | C23 | C22 | H22 | 143.3° | 169.8° |
| C24 | C23 | H23 | H24 | 117.7° | 120.2° |
| C23 | C24 | H25 | H26 | 118.9° | 120.2° |
| C23 | C24 | C25 | H27 | 64.3° | 68.1° |
| C23 | C24 | C25 | H28 | 176.0° | 171.3° |
| C24 | C25 | C20 | C21 | 30.0° | 18.3° |
| C24 | C25 | C20 | H27 | 120.1° | 120.8° |
| C24 | C25 | C20 | H28 | 120.1° | 118.8° |
| C24 | C25 | C20 | C19 | 149.2° | 161.6° |
| C25 | C24 | C23 | H23 | 67.0° | 168.9° |
| C25 | C24 | C23 | H24 | 174.5° | 48.6° |
| C25 | C24 | H25 | H26 | 119.0° | 120.6° |
| C24 | C25 | H27 | H28 | 119.7° | 120.1° |
| S26 | C21 | C20 | C25 | 179.8° | 179.4° |
| S26 | C21 | C20 | C19 | 0.5° | 0.7° |
| C21 | S26 | C18 | C19 | 0.2° | 0.8° |
| C21 | S26 | C18 | N17 | 179.9° | 179.9° |
| S26 | C21 | C22 | H21 | 55.3° | 76.8° |
| S26 | C21 | C22 | H22 | 63.5° | 43.6° |
| C20 | C21 | S26 | C18 | 0.4° | 0.9° |
| C21 | C20 | C25 | C19 | 179.3° | 179.9° |
| C21 | C20 | C19 | C18 | 0.3° | 0.1° |
| C21 | C20 | C19 | C02 | 179.9° | 179.3° |
| C20 | C21 | C22 | H21 | 124.6° | 104.1° |
| C20 | C21 | C22 | H22 | 116.6° | 135.5° |
| C21 | C20 | C25 | H27 | 90.1° | 102.5° |
| C21 | C20 | C25 | H28 | 150.1° | 137.1° |
| S26 | C18 | C19 | C20 | 0.0° | 0.6° |
| S26 | C18 | C19 | N17 | 179.8° | 179.4° |
| S26 | C18 | C19 | C02 | 179.6° | 180.0° |
| S26 | C18 | N17 | C04 | 180.0° | 179.6° |
| C25 | C20 | C19 | C18 | 179.6° | 180.0° |
| C25 | C20 | C19 | C02 | 0.8° | 0.6° |
| C20 | C25 | C24 | H25 | 176.2° | 67.8° |
| C20 | C25 | C24 | H26 | 64.5° | 171.3° |
| C20 | C25 | H27 | H28 | 119.7° | 120.4° |
| C20 | C19 | C18 | C02 | 179.6° | 179.4° |
| C20 | C19 | C18 | N17 | 179.8° | 180.0° |
| C20 | C19 | C02 | N01 | 0.1° | 0.5° |
| C20 | C19 | C02 | N03 | 179.9° | 179.9° |
| C19 | C20 | C25 | H27 | 90.7° | 77.6° |
| C19 | C20 | C25 | H28 | 29.1° | 42.8° |
| C19 | C18 | N17 | C04 | 0.3° | 0.3° |
| C18 | C19 | C02 | N01 | 179.5° | 179.8° |
| C18 | C19 | C02 | N03 | 0.3° | 0.5° |
| N17 | C18 | C19 | C02 | 0.1° | 0.6° |
| C18 | N17 | C04 | N03 | 0.5° | 0.1° |
| C18 | N17 | C04 | S05 | 179.0° | 180.0° |
| C19 | C02 | N01 | N03 | 179.8° | 179.7° |
| C19 | C02 | N03 | C04 | 0.1° | 0.3° |
| C19 | C02 | N01 | H5 | 179.8° | 168.8° |
| C19 | C02 | N01 | H6 | 59.8° | 11.2° |
| N17 | C04 | N03 | C02 | 0.3° | 0.1° |
| N17 | C04 | N03 | S05 | 179.4° | 180.0° |
| N17 | C04 | S05 | C06 | 166.0° | 180.0° |
| N01 | C02 | N03 | C04 | 179.7° | 180.0° |
| C02 | N01 | H5 | H6 | 120.0° | 180.0° |
| C02 | N03 | C04 | S05 | 179.2° | 180.0° |
| N03 | C02 | N01 | H5 | 0.0° | 11.5° |
| N03 | C02 | N01 | H6 | 120.0° | 168.4° |
| N03 | C04 | S05 | C06 | 13.5° | 0.0° |
| C04 | S05 | C06 | C07 | 90.0° | 180.0° |
| C04 | S05 | C06 | H7 | 30.0° | 60.0° |
| C04 | S05 | C06 | H8 | 150.1° | 60.0° |
| S05 | C06 | C07 | H7 | 119.9° | 120.0° |
| S05 | C06 | C07 | H8 | 119.9° | 120.0° |
| S05 | C06 | C07 | N08 | 60.9° | 180.0° |
| S05 | C06 | C07 | O16 | 118.7° | 0.1° |
| S05 | C06 | H7 | H8 | 120.3° | 120.0° |
| C06 | C07 | N08 | O16 | 179.5° | 179.9° |
| C06 | C07 | N08 | C09 | 179.7° | 179.9° |
| C07 | C06 | H7 | H8 | 120.3° | 120.0° |
| C06 | C07 | N08 | H9 | 0.4° | 0.0° |
| C15 | C14 | N11 | H16 | 120.3° | 120.0° |
| C15 | C14 | N11 | H17 | 120.3° | 120.1° |
| C15 | C14 | N11 | C10 | 141.4° | 76.0° |
| C15 | C14 | N11 | C12 | 94.6° | 160.0° |
| C15 | C14 | H16 | H17 | 119.3° | 120.1° |
| C14 | C15 | H18 | H19 | 120.0° | 120.0° |
| C14 | C15 | H18 | H20 | 120.0° | 120.0° |
| C14 | C15 | H19 | H20 | 120.0° | 120.0° |
| C14 | N11 | C10 | C12 | 124.1° | 124.0° |
| C14 | N11 | C10 | C09 | 104.1° | 170.0° |
| C14 | N11 | C12 | C13 | 95.0° | 71.8° |
| C14 | N11 | C10 | H1 | 135.4° | 70.1° |
| C14 | N11 | C10 | H2 | 16.4° | 50.0° |
| C14 | N11 | C12 | H3 | 144.2° | 168.2° |
| C14 | N11 | C12 | H4 | 25.9° | 48.2° |
| N11 | C14 | H16 | H17 | 119.2° | 120.0° |
| N11 | C14 | C15 | H18 | 180.0° | 178.4° |
| N11 | C14 | C15 | H19 | 60.0° | 58.4° |
| N11 | C14 | C15 | H20 | 60.0° | 61.7° |
| C07 | N08 | C09 | H9 | 180.0° | 179.9° |
| C07 | N08 | C09 | C10 | 159.1° | 180.0° |
| N08 | C07 | C06 | H7 | 59.0° | 60.0° |
| N08 | C07 | C06 | H8 | 179.2° | 60.0° |
| C07 | N08 | C09 | H10 | 80.7° | 59.9° |
| C07 | N08 | C09 | H11 | 38.9° | 60.0° |
| O16 | C07 | N08 | C09 | 0.2° | 0.0° |
| O16 | C07 | C06 | H7 | 121.4° | 120.0° |
| O16 | C07 | C06 | H8 | 1.2° | 120.0° |
| O16 | C07 | N08 | H9 | 179.9° | 179.9° |
| N08 | C09 | C10 | N11 | 66.4° | 180.0° |
| N08 | C09 | C10 | H10 | 120.2° | 120.1° |
| N08 | C09 | C10 | H11 | 120.2° | 120.0° |
| N08 | C09 | C10 | H1 | 173.1° | 60.1° |
| N08 | C09 | C10 | H2 | 54.1° | 59.9° |
| N08 | C09 | H10 | H11 | 119.4° | 120.0° |
| N11 | C10 | C09 | H1 | 120.5° | 119.9° |
| N11 | C10 | C09 | H2 | 120.5° | 120.1° |
| C10 | N11 | C12 | C13 | 29.4° | 164.2° |
| N11 | C10 | H1 | H2 | 118.4° | 120.1° |
| C10 | N11 | C12 | H3 | 91.5° | 44.2° |
| C10 | N11 | C12 | H4 | 150.2° | 75.8° |
| N11 | C10 | C09 | H10 | 173.4° | 59.9° |
| N11 | C10 | C09 | H11 | 53.8° | 60.1° |
| C10 | N11 | C14 | H16 | 98.3° | 164.1° |
| C10 | N11 | C14 | H17 | 21.2° | 44.1° |
| C12 | N11 | C10 | C09 | 131.8° | 66.0° |
| N11 | C12 | C13 | H3 | 120.8° | 120.0° |
| N11 | C12 | C13 | H4 | 120.8° | 120.0° |
| C12 | N11 | C10 | H1 | 11.3° | 53.9° |
| C12 | N11 | C10 | H2 | 107.7° | 174.0° |
| N11 | C12 | H3 | H4 | 117.4° | 120.0° |
| N11 | C12 | C13 | H13 | 180.0° | 174.1° |
| N11 | C12 | C13 | H14 | 60.0° | 65.9° |
| N11 | C12 | C13 | H15 | 60.0° | 54.1° |
| C12 | N11 | C14 | H16 | 25.7° | 40.1° |
| C12 | N11 | C14 | H17 | 145.2° | 79.9° |
| C09 | C10 | H1 | H2 | 118.5° | 120.0° |
| C10 | C09 | N08 | H9 | 20.9° | 0.1° |
| C10 | C09 | H10 | H11 | 119.4° | 120.0° |
| C13 | C12 | H3 | H4 | 117.4° | 120.0° |
| C12 | C13 | H13 | H14 | 120.0° | 120.0° |
| C12 | C13 | H13 | H15 | 120.0° | 120.0° |
| C12 | C13 | H14 | H15 | 120.0° | 120.0° |
| H1 | C10 | C09 | H10 | 52.9° | 60.0° |
| H1 | C10 | C09 | H11 | 66.7° | 180.0° |
| H2 | C10 | C09 | H10 | 66.1° | 180.0° |
| H2 | C10 | C09 | H11 | 174.3° | 60.0° |
| H3 | C12 | C13 | H13 | 59.2° | 54.1° |
| H3 | C12 | C13 | H14 | 179.2° | 174.1° |
| H3 | C12 | C13 | H15 | 60.8° | 65.9° |
| H4 | C12 | C13 | H13 | 59.2° | 65.9° |
| H4 | C12 | C13 | H14 | 60.9° | 54.1° |
| H4 | C12 | C13 | H15 | 179.1° | 174.0° |
| H9 | N08 | C09 | H10 | 99.2° | 120.0° |
| H9 | N08 | C09 | H11 | 141.1° | 120.1° |
| H13 | C13 | H14 | H15 | 119.9° | 120.0° |
| H16 | C14 | C15 | H18 | 59.8° | 61.7° |
| H16 | C14 | C15 | H19 | 60.2° | 178.3° |
| H16 | C14 | C15 | H20 | 179.8° | 58.3° |
| H17 | C14 | C15 | H18 | 59.8° | 58.3° |
| H17 | C14 | C15 | H19 | 179.7° | 61.7° |
| H17 | C14 | C15 | H20 | 60.3° | 178.3° |
| H18 | C15 | H19 | H20 | 120.0° | 120.0° |
| H21 | C22 | C23 | H23 | 141.4° | 50.0° |
| H21 | C22 | C23 | H24 | 22.8° | 170.4° |
| H22 | C22 | C23 | H23 | 22.6° | 70.4° |
| H22 | C22 | C23 | H24 | 96.0° | 49.9° |
| H23 | C23 | C24 | H25 | 53.4° | 70.3° |
| H23 | C23 | C24 | H26 | 172.7° | 49.9° |
| H24 | C23 | C24 | H25 | 65.1° | 169.4° |
| H24 | C23 | C24 | H26 | 54.1° | 70.4° |
| H25 | C24 | C25 | H27 | 56.1° | 171.9° |
| H25 | C24 | C25 | H28 | 63.7° | 51.4° |
| H26 | C24 | C25 | H27 | 175.4° | 51.1° |
| H26 | C24 | C25 | H28 | 55.7° | 69.5° |
