WZQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C29 | C28 | sing | 1.54Å | 1.51Å | |
| C29 | S30 | sing | 1.85Å | 1.78Å | |
| N27 | C28 | sing | 1.47Å | 1.34Å | |
| N27 | C25 | sing | 1.34Å | 1.51Å | |
| C28 | C23 | sing | 1.53Å | 1.67Å | |
| S30 | C22 | sing | 1.84Å | 1.51Å | |
| C25 | O26 | doub | 1.22Å | 1.21Å | |
| C25 | N24 | sing | 1.34Å | 1.56Å | |
| C23 | C22 | sing | 1.54Å | 1.69Å | |
| C23 | N24 | sing | 1.47Å | 1.32Å | |
| C22 | C21 | sing | 1.53Å | 1.65Å | |
| C21 | C20 | sing | 1.53Å | 1.54Å | |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| C19 | C18 | sing | 1.53Å | 1.53Å | |
| C13 | N01 | sing | 1.47Å | 1.47Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| C18 | C16 | sing | 1.51Å | 1.51Å | |
| N15 | C16 | sing | 1.35Å | 1.48Å | |
| N15 | C14 | sing | 1.47Å | 1.47Å | |
| C16 | O17 | doub | 1.21Å | 1.16Å | |
| N01 | C02 | sing | 1.47Å | 1.48Å | |
| C02 | C03 | sing | 1.51Å | 1.55Å | |
| N08 | C03 | doub | 1.32Å | 1.35Å | Aromatic |
| N08 | C07 | sing | 1.32Å | 1.34Å | Aromatic |
| C03 | C04 | sing | 1.38Å | 1.41Å | Aromatic |
| C07 | C06 | doub | 1.39Å | 1.42Å | Aromatic |
| C04 | C05 | doub | 1.39Å | 1.42Å | Aromatic |
| C06 | C05 | sing | 1.39Å | 1.42Å | Aromatic |
| C06 | O09 | sing | 1.36Å | 1.44Å | |
| C05 | C12 | sing | 1.50Å | 1.56Å | |
| C10 | O09 | sing | 1.43Å | 1.39Å | |
| C10 | C11 | sing | 1.53Å | 1.50Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| N01 | H011 | sing | 1.01Å | 1.00Å | |
| N15 | H151 | sing | 0.97Å | 1.00Å | |
| N24 | H241 | sing | 0.97Å | 1.00Å | |
| N27 | H271 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C28 | C29 | S30 | 108.7° | 102.7° |
| C29 | C28 | N27 | 110.4° | 109.5° |
| C29 | C28 | C23 | 104.3° | 112.3° |
| C29 | C28 | H281 | 111.7° | 110.3° |
| C28 | C29 | H292 | 109.7° | 110.8° |
| C28 | C29 | H291 | 109.7° | 110.7° |
| C29 | S30 | C22 | 95.6° | 94.6° |
| S30 | C29 | H292 | 109.7° | 111.1° |
| S30 | C29 | H291 | 109.7° | 110.5° |
| C28 | N27 | C25 | 110.4° | 109.1° |
| N27 | C28 | C23 | 105.5° | 104.0° |
| N27 | C28 | H281 | 114.6° | 110.3° |
| C28 | N27 | H271 | 124.8° | 125.5° |
| N27 | C25 | O26 | 129.6° | 123.1° |
| N27 | C25 | N24 | 107.0° | 113.8° |
| C25 | N27 | H271 | 124.8° | 125.4° |
| C28 | C23 | C22 | 103.3° | 112.4° |
| C28 | C23 | N24 | 110.0° | 104.0° |
| C28 | C23 | H231 | 108.5° | 110.6° |
| C23 | C28 | H281 | 109.6° | 110.2° |
| S30 | C22 | C23 | 106.1° | 102.9° |
| S30 | C22 | C21 | 123.9° | 110.7° |
| S30 | C22 | H221 | 110.3° | 110.8° |
| O26 | C25 | N24 | 123.4° | 123.1° |
| C25 | N24 | C23 | 107.1° | 109.1° |
| C25 | N24 | H241 | 126.5° | 125.5° |
| C22 | C23 | N24 | 112.8° | 109.2° |
| C23 | C22 | C21 | 98.6° | 110.8° |
| C23 | C22 | H221 | 108.0° | 110.8° |
| C22 | C23 | H231 | 108.2° | 110.2° |
| N24 | C23 | H231 | 113.6° | 110.3° |
| C23 | N24 | H241 | 126.4° | 125.5° |
| C22 | C21 | C20 | 114.2° | 109.5° |
| C22 | C21 | H212 | 108.3° | 109.4° |
| C22 | C21 | H211 | 108.3° | 109.5° |
| C21 | C22 | H221 | 108.4° | 110.7° |
| C21 | C20 | C19 | 110.7° | 109.5° |
| C21 | C20 | H201 | 109.2° | 109.4° |
| C21 | C20 | H202 | 109.2° | 109.5° |
| C20 | C21 | H212 | 108.3° | 109.4° |
| C20 | C21 | H211 | 108.3° | 109.5° |
| C20 | C19 | C18 | 118.6° | 109.5° |
| C20 | C19 | H192 | 107.2° | 109.4° |
| C20 | C19 | H191 | 107.1° | 109.5° |
| C19 | C20 | H201 | 109.2° | 109.4° |
| C19 | C20 | H202 | 109.2° | 109.5° |
| C19 | C18 | C16 | 116.3° | 109.5° |
| C19 | C18 | H182 | 107.7° | 109.4° |
| C19 | C18 | H181 | 107.7° | 109.5° |
| C18 | C19 | H192 | 107.1° | 109.4° |
| C18 | C19 | H191 | 107.1° | 109.5° |
| N01 | C13 | C14 | 110.7° | 109.4° |
| C13 | N01 | C02 | 115.8° | 111.0° |
| N01 | C13 | H131 | 109.1° | 109.5° |
| N01 | C13 | H132 | 109.2° | 109.5° |
| C13 | N01 | H011 | 107.9° | 111.0° |
| C13 | C14 | N15 | 112.5° | 109.4° |
| C14 | C13 | H131 | 109.1° | 109.5° |
| C14 | C13 | H132 | 109.2° | 109.5° |
| C13 | C14 | H141 | 108.7° | 109.5° |
| C13 | C14 | H142 | 108.7° | 109.5° |
| C18 | C16 | N15 | 122.2° | 120.0° |
| C18 | C16 | O17 | 119.1° | 120.0° |
| C16 | C18 | H182 | 107.7° | 109.5° |
| C16 | C18 | H181 | 107.7° | 109.5° |
| C16 | N15 | C14 | 116.4° | 120.0° |
| N15 | C16 | O17 | 118.5° | 120.0° |
| C16 | N15 | H151 | 121.8° | 120.0° |
| N15 | C14 | H141 | 108.7° | 109.5° |
| N15 | C14 | H142 | 108.7° | 109.4° |
| C14 | N15 | H151 | 121.8° | 120.0° |
| N01 | C02 | C03 | 105.2° | 109.5° |
| N01 | C02 | H022 | 110.5° | 109.5° |
| N01 | C02 | H021 | 110.5° | 109.5° |
| C02 | N01 | H011 | 107.8° | 111.0° |
| C02 | C03 | N08 | 117.7° | 119.6° |
| C02 | C03 | C04 | 122.7° | 119.6° |
| C03 | C02 | H022 | 110.5° | 109.4° |
| C03 | C02 | H021 | 110.5° | 109.5° |
| C03 | N08 | C07 | 123.9° | 121.9° |
| N08 | C03 | C04 | 119.7° | 120.8° |
| N08 | C07 | C06 | 119.5° | 120.6° |
| N08 | C07 | H071 | 120.3° | 119.7° |
| C03 | C04 | C05 | 118.7° | 119.1° |
| C03 | C04 | H041 | 120.6° | 120.4° |
| C07 | C06 | C05 | 118.9° | 118.9° |
| C07 | C06 | O09 | 119.7° | 119.3° |
| C06 | C07 | H071 | 120.3° | 119.7° |
| C04 | C05 | C06 | 119.3° | 118.6° |
| C04 | C05 | C12 | 121.0° | 119.7° |
| C05 | C04 | H041 | 120.6° | 120.4° |
| C05 | C06 | O09 | 121.4° | 121.8° |
| C06 | C05 | C12 | 119.7° | 121.6° |
| C06 | O09 | C10 | 111.8° | 117.7° |
| C05 | C12 | C11 | 111.9° | 109.6° |
| C05 | C12 | H121 | 108.8° | 109.5° |
| C05 | C12 | H122 | 108.9° | 109.5° |
| O09 | C10 | C11 | 112.0° | 108.5° |
| O09 | C10 | H102 | 108.8° | 109.7° |
| O09 | C10 | H101 | 108.8° | 109.7° |
| C10 | C11 | C12 | 113.1° | 108.3° |
| C11 | C10 | H102 | 108.8° | 109.6° |
| C11 | C10 | H101 | 108.8° | 109.6° |
| C10 | C11 | H112 | 108.5° | 109.6° |
| C10 | C11 | H111 | 108.6° | 109.7° |
| C12 | C11 | H112 | 108.6° | 109.7° |
| C12 | C11 | H111 | 108.5° | 109.8° |
| C11 | C12 | H121 | 108.9° | 109.4° |
| C11 | C12 | H122 | 108.8° | 109.5° |
| H102 | C10 | H101 | 109.5° | 109.7° |
| H112 | C11 | H111 | 109.5° | 109.7° |
| H121 | C12 | H122 | 109.5° | 109.4° |
| H131 | C13 | H132 | 109.5° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.5° |
| H182 | C18 | H181 | 109.5° | 109.4° |
| H192 | C19 | H191 | 109.5° | 109.5° |
| H201 | C20 | H202 | 109.5° | 109.5° |
| H212 | C21 | H211 | 109.5° | 109.5° |
| H022 | C02 | H021 | 109.4° | 109.4° |
| H292 | C29 | H291 | 109.5° | 110.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C28 | C29 | S30 | H292 | 119.9° | 118.4° |
| C28 | C29 | S30 | H291 | 119.9° | 118.1° |
| C29 | C28 | N27 | C23 | 112.1° | 120.3° |
| C29 | C28 | N27 | H281 | 127.2° | 121.5° |
| C29 | C28 | N27 | C25 | 109.2° | 120.3° |
| C29 | C28 | C23 | H281 | 119.7° | 123.4° |
| C28 | C29 | S30 | C22 | 42.0° | 34.9° |
| C29 | C28 | C23 | C22 | 7.1° | 0.4° |
| C29 | C28 | C23 | N24 | 113.5° | 118.4° |
| C29 | C28 | C23 | H231 | 121.8° | 123.3° |
| C28 | C29 | H292 | H291 | 120.3° | 123.3° |
| C29 | C28 | N27 | H271 | 70.8° | 59.8° |
| S30 | C29 | C28 | N27 | 93.0° | 90.1° |
| S30 | C29 | C28 | C23 | 19.9° | 25.0° |
| C29 | S30 | C22 | C23 | 44.6° | 34.7° |
| C29 | S30 | C22 | C21 | 157.0° | 153.1° |
| C29 | S30 | C22 | H221 | 72.2° | 83.7° |
| S30 | C29 | C28 | H281 | 138.2° | 148.3° |
| S30 | C29 | H292 | H291 | 120.4° | 123.3° |
| C28 | N27 | C25 | H271 | 180.0° | 179.9° |
| N27 | C28 | C23 | H281 | 123.9° | 118.3° |
| C28 | N27 | C25 | O26 | 177.7° | 180.0° |
| C28 | N27 | C25 | N24 | 2.2° | 0.1° |
| N27 | C28 | C23 | C22 | 123.5° | 118.0° |
| N27 | C28 | C23 | N24 | 2.9° | 0.0° |
| N27 | C28 | C23 | H231 | 121.8° | 118.4° |
| N27 | C28 | C29 | H292 | 147.2° | 151.2° |
| N27 | C28 | C29 | H291 | 26.9° | 27.9° |
| C25 | N27 | C28 | C23 | 2.9° | 0.0° |
| N27 | C25 | O26 | N24 | 179.9° | 179.9° |
| N27 | C25 | N24 | C23 | 0.2° | 0.0° |
| C25 | N27 | C28 | H281 | 123.6° | 118.1° |
| N27 | C25 | N24 | H241 | 179.8° | 179.9° |
| C28 | C23 | C22 | S30 | 36.7° | 24.5° |
| C28 | C23 | N24 | C25 | 1.5° | 0.0° |
| C28 | C23 | C22 | N24 | 118.7° | 114.9° |
| C28 | C23 | C22 | H231 | 114.9° | 123.8° |
| C28 | C23 | N24 | H231 | 121.8° | 118.5° |
| C28 | C23 | C22 | C21 | 165.8° | 142.9° |
| C28 | C23 | C22 | H221 | 81.5° | 93.9° |
| C23 | C28 | C29 | H292 | 100.0° | 93.7° |
| C23 | C28 | C29 | H291 | 139.8° | 143.0° |
| C28 | C23 | N24 | H241 | 178.5° | 179.9° |
| C23 | C28 | N27 | H271 | 177.1° | 179.9° |
| S30 | C22 | C23 | C21 | 129.1° | 118.4° |
| S30 | C22 | C23 | H221 | 118.3° | 118.4° |
| S30 | C22 | C23 | N24 | 81.9° | 90.3° |
| S30 | C22 | C21 | H221 | 131.5° | 123.2° |
| S30 | C22 | C21 | C20 | 107.7° | 69.0° |
| S30 | C22 | C21 | H212 | 13.1° | 171.1° |
| S30 | C22 | C21 | H211 | 131.7° | 51.1° |
| S30 | C22 | C23 | H231 | 151.6° | 148.4° |
| C22 | S30 | C29 | H292 | 77.8° | 83.6° |
| C22 | S30 | C29 | H291 | 161.9° | 153.0° |
| O26 | C25 | N24 | C23 | 179.7° | 180.0° |
| O26 | C25 | N24 | H241 | 0.3° | 0.1° |
| O26 | C25 | N27 | H271 | 2.2° | 0.1° |
| C25 | N24 | C23 | C22 | 116.2° | 120.2° |
| C25 | N24 | C23 | H241 | 180.0° | 179.9° |
| C25 | N24 | C23 | H231 | 120.3° | 118.5° |
| N24 | C25 | N27 | H271 | 177.8° | 179.9° |
| C22 | C23 | N24 | H231 | 123.5° | 121.3° |
| C23 | C22 | C21 | H221 | 112.4° | 123.3° |
| C23 | C22 | C21 | C20 | 136.3° | 177.5° |
| C23 | C22 | C21 | H212 | 103.0° | 57.6° |
| C23 | C22 | C21 | H211 | 15.6° | 62.4° |
| C22 | C23 | C28 | H281 | 112.6° | 123.8° |
| C22 | C23 | N24 | H241 | 63.8° | 59.9° |
| N24 | C23 | C22 | C21 | 47.1° | 28.0° |
| N24 | C23 | C22 | H221 | 159.8° | 151.2° |
| N24 | C23 | C28 | H281 | 126.8° | 118.2° |
| C22 | C21 | C20 | H212 | 120.7° | 120.0° |
| C22 | C21 | C20 | H211 | 120.7° | 120.1° |
| C22 | C21 | C20 | C19 | 108.5° | 180.0° |
| C22 | C21 | C20 | H201 | 131.3° | 60.0° |
| C22 | C21 | C20 | H202 | 11.7° | 59.9° |
| C22 | C21 | H212 | H211 | 117.9° | 120.0° |
| C21 | C22 | C23 | H231 | 79.3° | 93.3° |
| C21 | C20 | C19 | H201 | 120.2° | 119.9° |
| C21 | C20 | C19 | H202 | 120.2° | 120.1° |
| C21 | C20 | C19 | C18 | 161.7° | 180.0° |
| C21 | C20 | C19 | H192 | 77.0° | 60.1° |
| C21 | C20 | C19 | H191 | 40.5° | 59.9° |
| C21 | C20 | H201 | H202 | 119.4° | 120.0° |
| C20 | C21 | H212 | H211 | 117.8° | 120.0° |
| C20 | C21 | C22 | H221 | 23.9° | 54.2° |
| C20 | C19 | C18 | H192 | 121.3° | 120.0° |
| C20 | C19 | C18 | H191 | 121.3° | 120.1° |
| C20 | C19 | C18 | C16 | 29.5° | 180.0° |
| C20 | C19 | C18 | H182 | 150.5° | 60.0° |
| C20 | C19 | C18 | H181 | 91.5° | 59.9° |
| C20 | C19 | H192 | H191 | 115.9° | 120.0° |
| C19 | C20 | H201 | H202 | 119.5° | 120.0° |
| C19 | C20 | C21 | H212 | 12.2° | 60.0° |
| C19 | C20 | C21 | H211 | 130.8° | 59.9° |
| C19 | C18 | C16 | H182 | 121.0° | 120.0° |
| C19 | C18 | C16 | H181 | 121.0° | 120.1° |
| C19 | C18 | C16 | N15 | 120.3° | 180.0° |
| C19 | C18 | C16 | O17 | 64.8° | 0.1° |
| C19 | C18 | H182 | H181 | 116.9° | 120.0° |
| C18 | C19 | H192 | H191 | 115.8° | 120.0° |
| C18 | C19 | C20 | H201 | 41.6° | 60.1° |
| C18 | C19 | C20 | H202 | 78.1° | 59.9° |
| N01 | C13 | C14 | H131 | 120.2° | 120.0° |
| N01 | C13 | C14 | H132 | 120.2° | 120.0° |
| N01 | C13 | C14 | N15 | 170.6° | 180.0° |
| C13 | N01 | C02 | H011 | 120.9° | 123.9° |
| C13 | N01 | C02 | C03 | 178.2° | 180.0° |
| N01 | C13 | H131 | H132 | 119.4° | 120.0° |
| N01 | C13 | C14 | H141 | 68.9° | 60.0° |
| N01 | C13 | C14 | H142 | 50.2° | 60.1° |
| C13 | N01 | C02 | H022 | 58.8° | 60.0° |
| C13 | N01 | C02 | H021 | 62.5° | 60.0° |
| C13 | C14 | N15 | C16 | 116.1° | 180.0° |
| C13 | C14 | N15 | H141 | 120.4° | 120.0° |
| C13 | C14 | N15 | H142 | 120.5° | 120.0° |
| C14 | C13 | N01 | C02 | 68.3° | 180.0° |
| C14 | C13 | H131 | H132 | 119.4° | 120.0° |
| C13 | C14 | H141 | H142 | 118.6° | 120.1° |
| C14 | C13 | N01 | H011 | 52.6° | 56.1° |
| C13 | C14 | N15 | H151 | 63.9° | 0.0° |
| C18 | C16 | N15 | O17 | 174.9° | 179.9° |
| C18 | C16 | N15 | C14 | 176.5° | 180.0° |
| C16 | C18 | H182 | H181 | 116.9° | 120.0° |
| C16 | C18 | C19 | H192 | 91.8° | 60.1° |
| C16 | C18 | C19 | H191 | 150.8° | 59.9° |
| C18 | C16 | N15 | H151 | 3.5° | 0.1° |
| C16 | N15 | C14 | H151 | 180.0° | 180.0° |
| C16 | N15 | C14 | H141 | 4.3° | 60.0° |
| C16 | N15 | C14 | H142 | 123.4° | 60.0° |
| N15 | C16 | C18 | H182 | 0.7° | 60.0° |
| N15 | C16 | C18 | H181 | 118.7° | 59.9° |
| C14 | N15 | C16 | O17 | 1.6° | 0.1° |
| N15 | C14 | C13 | H131 | 50.5° | 60.0° |
| N15 | C14 | C13 | H132 | 69.1° | 60.0° |
| N15 | C14 | H141 | H142 | 118.6° | 119.9° |
| O17 | C16 | C18 | H182 | 174.2° | 120.1° |
| O17 | C16 | C18 | H181 | 56.2° | 120.0° |
| O17 | C16 | N15 | H151 | 178.5° | 180.0° |
| N01 | C02 | C03 | H022 | 119.4° | 120.0° |
| N01 | C02 | C03 | H021 | 119.3° | 120.1° |
| N01 | C02 | C03 | N08 | 13.7° | 85.0° |
| N01 | C02 | C03 | C04 | 166.5° | 95.0° |
| C02 | N01 | C13 | H131 | 51.9° | 60.0° |
| C02 | N01 | C13 | H132 | 171.5° | 60.0° |
| N01 | C02 | H022 | H021 | 121.9° | 120.0° |
| C02 | C03 | N08 | C04 | 179.8° | 180.0° |
| C02 | C03 | N08 | C07 | 179.7° | 179.9° |
| C02 | C03 | C04 | C05 | 179.8° | 179.9° |
| C03 | C02 | H022 | H021 | 122.0° | 120.0° |
| C02 | C03 | C04 | H041 | 0.2° | 0.1° |
| C03 | C02 | N01 | H011 | 60.9° | 56.1° |
| C03 | N08 | C07 | C06 | 0.2° | 0.0° |
| N08 | C03 | C04 | C05 | 0.0° | 0.1° |
| N08 | C03 | C02 | H022 | 133.0° | 35.0° |
| N08 | C03 | C02 | H021 | 105.6° | 154.9° |
| N08 | C03 | C04 | H041 | 179.9° | 179.9° |
| C03 | N08 | C07 | H071 | 179.8° | 179.9° |
| C07 | N08 | C03 | C04 | 0.1° | 0.1° |
| N08 | C07 | C06 | H071 | 180.0° | 180.0° |
| N08 | C07 | C06 | C05 | 0.1° | 0.1° |
| N08 | C07 | C06 | O09 | 179.9° | 179.7° |
| C03 | C04 | C05 | H041 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 0.1° | 0.0° |
| C03 | C04 | C05 | C12 | 179.8° | 179.9° |
| C04 | C03 | C02 | H022 | 47.2° | 145.0° |
| C04 | C03 | C02 | H021 | 74.1° | 25.1° |
| C07 | C06 | C05 | C04 | 0.0° | 0.1° |
| C07 | C06 | C05 | O09 | 180.0° | 179.8° |
| C07 | C06 | C05 | C12 | 179.9° | 179.8° |
| C07 | C06 | O09 | C10 | 149.3° | 163.0° |
| C04 | C05 | C06 | C12 | 180.0° | 179.9° |
| C04 | C05 | C06 | O09 | 179.9° | 179.7° |
| C04 | C05 | C12 | C11 | 179.4° | 162.4° |
| C04 | C05 | C12 | H121 | 59.0° | 42.5° |
| C04 | C05 | C12 | H122 | 60.2° | 77.5° |
| C05 | C06 | O09 | C10 | 30.8° | 17.1° |
| C06 | C05 | C12 | C11 | 0.5° | 17.7° |
| C06 | C05 | C12 | H121 | 120.9° | 137.6° |
| C06 | C05 | C12 | H122 | 119.8° | 102.4° |
| C06 | C05 | C04 | H041 | 179.9° | 180.0° |
| C05 | C06 | C07 | H071 | 179.9° | 179.8° |
| O09 | C06 | C05 | C12 | 0.1° | 0.4° |
| C06 | O09 | C10 | C11 | 60.4° | 49.1° |
| C06 | O09 | C10 | H102 | 179.2° | 70.6° |
| C06 | O09 | C10 | H101 | 60.0° | 168.8° |
| O09 | C06 | C07 | H071 | 0.1° | 0.3° |
| C05 | C12 | C11 | C10 | 27.2° | 48.0° |
| C05 | C12 | C11 | H121 | 120.3° | 120.0° |
| C05 | C12 | C11 | H122 | 120.4° | 120.1° |
| C05 | C12 | C11 | H112 | 93.3° | 71.7° |
| C05 | C12 | C11 | H111 | 147.8° | 167.7° |
| C05 | C12 | H121 | H122 | 118.9° | 120.0° |
| C12 | C05 | C04 | H041 | 0.2° | 0.1° |
| O09 | C10 | C11 | H102 | 120.4° | 119.7° |
| O09 | C10 | C11 | H101 | 120.4° | 119.8° |
| O09 | C10 | C11 | C12 | 60.2° | 64.7° |
| O09 | C10 | H102 | H101 | 118.8° | 120.5° |
| O09 | C10 | C11 | H112 | 60.4° | 55.1° |
| O09 | C10 | C11 | H111 | 179.3° | 175.6° |
| C10 | C11 | C12 | H112 | 120.5° | 119.7° |
| C10 | C11 | C12 | H111 | 120.5° | 119.7° |
| C11 | C10 | H102 | H101 | 118.8° | 120.4° |
| C10 | C11 | H112 | H111 | 118.4° | 120.5° |
| C10 | C11 | C12 | H121 | 93.1° | 168.0° |
| C10 | C11 | C12 | H122 | 147.6° | 72.1° |
| C12 | C11 | C10 | H102 | 179.5° | 55.1° |
| C12 | C11 | C10 | H101 | 60.2° | 175.6° |
| C12 | C11 | H112 | H111 | 118.3° | 120.7° |
| C11 | C12 | H121 | H122 | 118.9° | 119.9° |
| H102 | C10 | C11 | H112 | 60.0° | 174.8° |
| H102 | C10 | C11 | H111 | 58.9° | 64.7° |
| H101 | C10 | C11 | H112 | 179.2° | 64.7° |
| H101 | C10 | C11 | H111 | 60.3° | 55.8° |
| H112 | C11 | C12 | H121 | 146.4° | 48.3° |
| H112 | C11 | C12 | H122 | 27.1° | 168.2° |
| H111 | C11 | C12 | H121 | 27.4° | 72.3° |
| H111 | C11 | C12 | H122 | 91.9° | 47.6° |
| H131 | C13 | C14 | H141 | 170.9° | 60.0° |
| H131 | C13 | C14 | H142 | 70.0° | 180.0° |
| H131 | C13 | N01 | H011 | 172.8° | 176.1° |
| H132 | C13 | C14 | H141 | 51.3° | 180.0° |
| H132 | C13 | C14 | H142 | 170.4° | 60.0° |
| H132 | C13 | N01 | H011 | 67.6° | 63.9° |
| H141 | C14 | N15 | H151 | 175.7° | 120.0° |
| H142 | C14 | N15 | H151 | 56.6° | 120.0° |
| H182 | C18 | C19 | H192 | 29.2° | 180.0° |
| H182 | C18 | C19 | H191 | 88.2° | 60.1° |
| H181 | C18 | C19 | H192 | 147.2° | 60.0° |
| H181 | C18 | C19 | H191 | 29.8° | NaN° |
| H192 | C19 | C20 | H201 | 162.8° | 180.0° |
| H192 | C19 | C20 | H202 | 43.2° | 60.0° |
| H191 | C19 | C20 | H201 | 79.7° | 60.0° |
| H191 | C19 | C20 | H202 | 160.6° | 180.0° |
| H201 | C20 | C21 | H212 | 108.0° | 180.0° |
| H201 | C20 | C21 | H211 | 10.6° | 60.0° |
| H202 | C20 | C21 | H212 | 132.4° | 60.0° |
| H202 | C20 | C21 | H211 | 109.0° | 180.0° |
| H212 | C21 | C22 | H221 | 144.6° | 65.7° |
| H211 | C21 | C22 | H221 | 96.8° | 174.3° |
| H221 | C22 | C23 | H231 | 33.3° | 29.9° |
| H231 | C23 | C28 | H281 | 2.1° | 0.1° |
| H231 | C23 | N24 | H241 | 59.7° | 61.4° |
| H022 | C02 | N01 | H011 | 179.7° | 63.9° |
| H021 | C02 | N01 | H011 | 58.4° | 176.1° |
| H281 | C28 | C29 | H292 | 18.4° | 29.6° |
| H281 | C28 | C29 | H291 | 101.9° | 93.7° |
| H281 | C28 | N27 | H271 | 56.4° | 61.7° |
