VIZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N02 | O01 | sing | 1.42Å | 1.40Å | |
| C03 | N02 | sing | 1.36Å | 1.66Å | |
| C05 | C04 | sing | 1.51Å | 1.53Å | |
| O06 | C05 | doub | 1.21Å | 1.26Å | |
| O07 | C05 | sing | 1.34Å | 1.26Å | |
| C04 | C03 | sing | 1.51Å | 1.52Å | |
| C08 | C03 | doub | 1.33Å | 1.53Å | |
| S09 | C08 | sing | 1.77Å | 1.60Å | |
| C10 | S09 | sing | 1.72Å | 1.68Å | |
| N11 | C10 | doub | 1.34Å | 1.25Å | |
| C12 | N11 | sing | 1.33Å | 1.45Å | |
| S14 | C13 | sing | 1.81Å | 1.82Å | |
| C16 | C15 | sing | 1.51Å | 1.52Å | |
| C17 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.36Å | 1.38Å | Aromatic |
| C19 | C18 | doub | 1.41Å | 1.41Å | Aromatic |
| C21 | C20 | doub | 1.36Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.39Å | 1.39Å | Aromatic |
| C23 | C22 | doub | 1.36Å | 1.38Å | Aromatic |
| C20 | C19 | sing | 1.41Å | 1.40Å | Aromatic |
| C24 | C19 | sing | 1.42Å | 1.37Å | Aromatic |
| C25 | C24 | doub | 1.41Å | 1.39Å | Aromatic |
| C15 | S14 | sing | 1.81Å | 1.82Å | |
| O26 | S14 | doub | 1.42Å | 1.46Å | |
| O27 | S14 | doub | 1.42Å | 1.46Å | |
| C13 | C12 | sing | 1.51Å | 1.52Å | |
| O28 | C12 | doub | 1.22Å | 1.19Å | |
| N02 | C10 | sing | 1.35Å | 1.57Å | |
| C16 | C25 | sing | 1.36Å | 1.38Å | Aromatic |
| C23 | C24 | sing | 1.41Å | 1.40Å | Aromatic |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| O01 | H011 | sing | 0.97Å | 0.95Å | |
| O07 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | N02 | C03 | 128.3° | 121.4° |
| O01 | N02 | C10 | 126.6° | 121.5° |
| N02 | O01 | H011 | 109.5° | 114.0° |
| N02 | C03 | C04 | 125.6° | 121.6° |
| N02 | C03 | C08 | 111.8° | 116.8° |
| C03 | N02 | C10 | 105.0° | 117.1° |
| C04 | C05 | O06 | 120.3° | 120.0° |
| C04 | C05 | O07 | 119.2° | 120.0° |
| C05 | C04 | C03 | 111.0° | 109.4° |
| C05 | C04 | H041 | 109.1° | 109.5° |
| C05 | C04 | H042 | 109.1° | 109.5° |
| O06 | C05 | O07 | 120.5° | 120.0° |
| C05 | O07 | H1 | 109.5° | 117.0° |
| C04 | C03 | C08 | 122.6° | 121.6° |
| C03 | C04 | H041 | 109.1° | 109.5° |
| C03 | C04 | H042 | 109.1° | 109.4° |
| C03 | C08 | S09 | 108.1° | 105.5° |
| C03 | C08 | H081 | 126.0° | 127.2° |
| C08 | S09 | C10 | 106.7° | 94.9° |
| S09 | C08 | H081 | 126.0° | 127.3° |
| S09 | C10 | N11 | 128.7° | 127.1° |
| S09 | C10 | N02 | 108.4° | 105.8° |
| C10 | N11 | C12 | 126.3° | 120.0° |
| N11 | C10 | N02 | 123.0° | 127.1° |
| N11 | C12 | C13 | 114.9° | 119.9° |
| N11 | C12 | O28 | 124.5° | 120.0° |
| C13 | S14 | C15 | 111.5° | 101.9° |
| C13 | S14 | O26 | 110.8° | 108.6° |
| C13 | S14 | O27 | 110.3° | 108.6° |
| S14 | C13 | C12 | 110.8° | 109.4° |
| S14 | C13 | H131 | 109.1° | 109.4° |
| S14 | C13 | H132 | 109.1° | 109.5° |
| C15 | C16 | C17 | 121.0° | 119.5° |
| C16 | C15 | S14 | 106.6° | 109.5° |
| C15 | C16 | C25 | 117.9° | 119.5° |
| C16 | C15 | H152 | 110.2° | 109.5° |
| C16 | C15 | H151 | 110.2° | 109.5° |
| C16 | C17 | C18 | 119.0° | 121.0° |
| C17 | C16 | C25 | 121.1° | 121.0° |
| C16 | C17 | H171 | 120.5° | 119.5° |
| C17 | C18 | C19 | 119.6° | 119.6° |
| C18 | C17 | H171 | 120.5° | 119.5° |
| C17 | C18 | H181 | 120.2° | 120.2° |
| C18 | C19 | C20 | 120.3° | 121.3° |
| C18 | C19 | C24 | 120.9° | 119.4° |
| C19 | C18 | H181 | 120.2° | 120.2° |
| C20 | C21 | C22 | 120.4° | 121.0° |
| C21 | C20 | C19 | 120.4° | 119.6° |
| C21 | C20 | H201 | 119.8° | 120.2° |
| C20 | C21 | H211 | 119.8° | 119.5° |
| C21 | C22 | C23 | 119.6° | 121.0° |
| C22 | C21 | H211 | 119.8° | 119.5° |
| C21 | C22 | H221 | 120.2° | 119.5° |
| C22 | C23 | C24 | 119.4° | 119.7° |
| C23 | C22 | H221 | 120.2° | 119.6° |
| C22 | C23 | H231 | 120.3° | 120.1° |
| C20 | C19 | C24 | 118.7° | 119.4° |
| C19 | C20 | H201 | 119.8° | 120.2° |
| C19 | C24 | C25 | 119.4° | 119.4° |
| C19 | C24 | C23 | 121.4° | 119.4° |
| C24 | C25 | C16 | 119.9° | 119.6° |
| C25 | C24 | C23 | 119.2° | 121.3° |
| C24 | C25 | H251 | 120.1° | 120.2° |
| C15 | S14 | O26 | 111.6° | 108.5° |
| C15 | S14 | O27 | 110.6° | 108.6° |
| S14 | C15 | H152 | 110.2° | 109.5° |
| S14 | C15 | H151 | 110.2° | 109.4° |
| O26 | S14 | O27 | 101.7° | 119.2° |
| C13 | C12 | O28 | 120.6° | 120.0° |
| C12 | C13 | H131 | 109.2° | 109.5° |
| C12 | C13 | H132 | 109.1° | 109.5° |
| C16 | C25 | H251 | 120.1° | 120.2° |
| C24 | C23 | H231 | 120.3° | 120.2° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H152 | C15 | H151 | 109.4° | 109.5° |
| H041 | C04 | H042 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | N02 | C03 | C10 | 179.9° | 179.9° |
| O01 | N02 | C03 | C04 | 0.1° | 0.0° |
| O01 | N02 | C03 | C08 | 179.9° | 180.0° |
| O01 | N02 | C10 | S09 | 179.9° | 180.0° |
| O01 | N02 | C10 | N11 | 0.1° | 0.2° |
| N02 | C03 | C04 | C05 | 143.7° | 85.0° |
| N02 | C03 | C04 | C08 | 179.8° | 179.9° |
| N02 | C03 | C08 | S09 | 0.1° | 0.0° |
| C03 | N02 | C10 | S09 | 0.1° | 0.1° |
| C03 | N02 | C10 | N11 | 180.0° | 179.8° |
| N02 | C03 | C04 | H041 | 23.4° | 35.0° |
| N02 | C03 | C04 | H042 | 96.1° | 155.0° |
| N02 | C03 | C08 | H081 | 179.9° | 179.9° |
| C03 | N02 | O01 | H011 | 180.0° | 180.0° |
| C04 | C05 | O06 | O07 | 179.5° | 180.0° |
| C05 | C04 | C03 | H041 | 120.2° | 120.0° |
| C05 | C04 | C03 | H042 | 120.2° | 120.0° |
| C05 | C04 | C03 | C08 | 36.2° | 95.0° |
| C05 | C04 | H041 | H042 | 119.3° | 120.0° |
| C04 | C05 | O07 | H1 | 179.5° | 180.0° |
| O06 | C05 | C04 | C03 | 83.0° | 0.0° |
| O06 | C05 | C04 | H041 | 156.7° | 120.0° |
| O06 | C05 | C04 | H042 | 37.2° | 120.0° |
| O06 | C05 | O07 | H1 | 0.0° | 0.0° |
| O07 | C05 | C04 | C03 | 96.4° | 180.0° |
| O07 | C05 | C04 | H041 | 23.8° | 60.0° |
| O07 | C05 | C04 | H042 | 143.3° | 60.0° |
| C04 | C03 | C08 | S09 | 180.0° | 180.0° |
| C04 | C03 | N02 | C10 | 180.0° | 180.0° |
| C03 | C04 | H041 | H042 | 119.3° | 120.0° |
| C04 | C03 | C08 | H081 | 0.0° | 0.1° |
| C03 | C08 | S09 | H081 | 180.0° | 179.9° |
| C03 | C08 | S09 | C10 | 0.0° | 0.0° |
| C08 | C03 | N02 | C10 | 0.1° | 0.1° |
| C08 | C03 | C04 | H041 | 156.4° | 145.0° |
| C08 | C03 | C04 | H042 | 84.1° | 25.0° |
| C08 | S09 | C10 | N11 | 179.9° | 179.8° |
| C08 | S09 | C10 | N02 | 0.1° | 0.0° |
| S09 | C10 | N11 | N02 | 179.8° | 179.8° |
| S09 | C10 | N11 | C12 | 0.4° | 0.0° |
| C10 | S09 | C08 | H081 | 180.0° | 179.9° |
| C10 | N11 | C12 | C13 | 180.0° | 180.0° |
| C10 | N11 | C12 | O28 | 0.6° | 0.0° |
| N11 | C12 | C13 | S14 | 107.5° | 180.0° |
| N11 | C12 | C13 | O28 | 179.5° | 180.0° |
| C12 | N11 | C10 | N02 | 179.8° | 179.7° |
| N11 | C12 | C13 | H131 | 12.7° | 60.1° |
| N11 | C12 | C13 | H132 | 132.3° | 60.0° |
| C13 | S14 | C15 | C16 | 32.1° | 180.0° |
| C13 | S14 | C15 | O26 | 124.5° | 114.5° |
| C13 | S14 | C15 | O27 | 123.1° | 114.5° |
| C13 | S14 | O26 | O27 | 117.3° | 125.0° |
| S14 | C13 | C12 | H131 | 120.2° | 119.9° |
| S14 | C13 | C12 | H132 | 120.2° | 120.0° |
| S14 | C13 | C12 | O28 | 73.0° | 0.0° |
| S14 | C13 | H131 | H132 | 119.4° | 120.0° |
| C13 | S14 | C15 | H152 | 151.7° | 60.0° |
| C13 | S14 | C15 | H151 | 87.4° | 60.0° |
| C15 | C16 | C17 | C25 | 179.3° | 180.0° |
| C15 | C16 | C17 | C18 | 179.3° | 179.7° |
| C15 | C16 | C25 | C24 | 178.7° | 179.4° |
| C16 | C15 | S14 | H152 | 119.6° | 120.0° |
| C16 | C15 | S14 | H151 | 119.6° | 120.0° |
| C16 | C15 | S14 | O26 | 156.6° | 65.5° |
| C16 | C15 | S14 | O27 | 91.0° | 65.5° |
| C16 | C15 | H152 | H151 | 121.3° | 120.0° |
| C15 | C16 | C17 | H171 | 0.7° | 0.0° |
| C15 | C16 | C25 | H251 | 1.3° | 0.0° |
| C16 | C17 | C18 | H171 | 180.0° | 179.7° |
| C16 | C17 | C18 | C19 | 0.4° | 0.0° |
| C17 | C16 | C25 | C24 | 0.6° | 0.6° |
| C17 | C16 | C15 | S14 | 125.9° | 90.0° |
| C17 | C16 | C15 | H152 | 114.5° | 150.0° |
| C17 | C16 | C15 | H151 | 6.4° | 30.0° |
| C16 | C17 | C18 | H181 | 179.6° | 180.0° |
| C17 | C16 | C25 | H251 | 179.3° | 180.0° |
| C17 | C18 | C19 | H181 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 179.8° | 180.0° |
| C17 | C18 | C19 | C24 | 0.1° | 0.0° |
| C18 | C17 | C16 | C25 | 0.0° | 0.3° |
| C18 | C19 | C20 | C21 | 179.8° | 180.0° |
| C18 | C19 | C20 | C24 | 179.7° | 180.0° |
| C18 | C19 | C24 | C25 | 0.6° | 0.3° |
| C18 | C19 | C24 | C23 | 180.0° | 180.0° |
| C19 | C18 | C17 | H171 | 179.6° | 179.7° |
| C18 | C19 | C20 | H201 | 0.2° | 0.0° |
| C20 | C21 | C22 | H211 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.1° | 0.1° |
| C21 | C20 | C19 | H201 | 180.0° | 179.9° |
| C21 | C20 | C19 | C24 | 0.5° | 0.1° |
| C20 | C21 | C22 | H221 | 179.9° | 180.0° |
| C21 | C22 | C23 | H221 | 180.0° | 179.9° |
| C22 | C21 | C20 | C19 | 0.4° | 0.1° |
| C21 | C22 | C23 | C24 | 0.1° | 0.1° |
| C22 | C21 | C20 | H201 | 179.6° | 180.0° |
| C21 | C22 | C23 | H231 | 179.9° | 180.0° |
| C22 | C23 | C24 | C19 | 0.0° | 0.0° |
| C22 | C23 | C24 | C25 | 179.5° | 179.7° |
| C22 | C23 | C24 | H231 | 180.0° | 179.9° |
| C23 | C22 | C21 | H211 | 179.9° | 180.0° |
| C20 | C19 | C24 | C25 | 179.2° | 179.7° |
| C20 | C19 | C24 | C23 | 0.2° | 0.0° |
| C19 | C20 | C21 | H211 | 179.6° | 180.0° |
| C20 | C19 | C18 | H181 | 0.1° | 0.0° |
| C19 | C24 | C25 | C23 | 179.4° | 179.7° |
| C19 | C24 | C25 | C16 | 0.9° | 0.6° |
| C24 | C19 | C20 | H201 | 179.5° | 180.0° |
| C24 | C19 | C18 | H181 | 179.9° | 180.0° |
| C19 | C24 | C23 | H231 | 179.9° | 180.0° |
| C19 | C24 | C25 | H251 | 179.1° | 180.0° |
| C24 | C25 | C16 | H251 | 180.0° | 179.4° |
| C25 | C24 | C23 | H231 | 0.5° | 0.2° |
| C15 | S14 | O26 | O27 | 117.9° | 124.9° |
| C15 | S14 | C13 | C12 | 164.7° | 180.0° |
| S14 | C15 | C16 | C25 | 53.4° | 90.1° |
| C15 | S14 | C13 | H131 | 44.5° | 60.0° |
| C15 | S14 | C13 | H132 | 75.1° | 60.0° |
| S14 | C15 | H152 | H151 | 121.3° | 119.9° |
| O26 | S14 | C13 | C12 | 39.8° | 65.5° |
| O26 | S14 | C13 | H131 | 80.4° | 174.5° |
| O26 | S14 | C13 | H132 | 160.0° | 54.5° |
| O26 | S14 | C15 | H152 | 83.8° | 54.5° |
| O26 | S14 | C15 | H151 | 37.0° | 174.5° |
| O27 | S14 | C13 | C12 | 72.1° | 65.5° |
| O27 | S14 | C13 | H131 | 167.7° | 54.5° |
| O27 | S14 | C13 | H132 | 48.1° | 174.5° |
| O27 | S14 | C15 | H152 | 28.6° | 174.5° |
| O27 | S14 | C15 | H151 | 149.4° | 54.5° |
| C12 | C13 | H131 | H132 | 119.4° | 120.1° |
| O28 | C12 | C13 | H131 | 166.7° | 119.9° |
| O28 | C12 | C13 | H132 | 47.2° | 120.0° |
| C10 | N02 | O01 | H011 | 0.1° | 0.0° |
| C16 | C25 | C24 | C23 | 179.6° | 179.7° |
| C25 | C16 | C15 | H152 | 66.2° | 29.9° |
| C25 | C16 | C15 | H151 | 173.0° | 150.0° |
| C25 | C16 | C17 | H171 | 180.0° | 180.0° |
| C24 | C23 | C22 | H221 | 179.9° | 180.0° |
| C23 | C24 | C25 | H251 | 0.4° | 0.3° |
| H171 | C17 | C18 | H181 | 0.4° | 0.3° |
| H201 | C20 | C21 | H211 | 0.4° | 0.1° |
| H211 | C21 | C22 | H221 | 0.1° | 0.1° |
| H221 | C22 | C23 | H231 | 0.1° | 0.1° |
