SE1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O30 | C28 | doub | 1.22Å | 1.24Å | |
| C22 | C20 | sing | 1.53Å | 1.59Å | |
| C22 | C23 | sing | 1.53Å | 1.57Å | |
| O29 | C28 | sing | 1.35Å | 1.30Å | |
| C28 | C04 | sing | 1.47Å | 1.53Å | |
| C20 | C19 | sing | 1.53Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.62Å | |
| C19 | C18 | sing | 1.53Å | 1.55Å | |
| C23 | C25 | sing | 1.53Å | 1.63Å | |
| C23 | C24 | sing | 1.53Å | 1.41Å | |
| C13 | C12 | doub | 1.38Å | 1.37Å | Aromatic |
| C13 | C08 | sing | 1.39Å | 1.30Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.37Å | Aromatic |
| C21 | C16 | sing | 1.53Å | 1.57Å | |
| C04 | C03 | doub | 1.40Å | 1.34Å | Aromatic |
| C04 | C05 | sing | 1.40Å | 1.37Å | Aromatic |
| C03 | C02 | sing | 1.38Å | 1.37Å | Aromatic |
| C25 | C18 | sing | 1.53Å | 1.58Å | |
| S07 | C08 | sing | 1.76Å | 1.78Å | |
| S07 | C05 | sing | 1.76Å | 1.76Å | |
| C24 | C16 | sing | 1.53Å | 1.42Å | |
| C08 | C09 | doub | 1.39Å | 1.30Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C17 | sing | 1.53Å | 1.61Å | |
| C05 | C06 | doub | 1.39Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.53Å | 1.58Å | |
| C16 | N15 | sing | 1.46Å | 1.55Å | |
| C02 | C01 | doub | 1.39Å | 1.39Å | Aromatic |
| C09 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C09 | S14 | sing | 1.76Å | 1.84Å | |
| N15 | S14 | sing | 1.66Å | 1.74Å | |
| C06 | C01 | sing | 1.38Å | 1.38Å | Aromatic |
| S14 | O26 | doub | 1.42Å | 1.49Å | |
| S14 | O27 | doub | 1.42Å | 1.43Å | |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C02 | H021 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| N15 | H151 | sing | 0.97Å | 1.00Å | |
| O29 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O30 | C28 | O29 | 119.6° | 120.0° |
| O30 | C28 | C04 | 119.9° | 120.0° |
| C20 | C22 | C23 | 111.3° | 109.5° |
| C22 | C20 | C19 | 112.1° | 109.4° |
| C22 | C20 | C21 | 98.3° | 109.4° |
| C22 | C20 | H201 | 111.7° | 109.5° |
| C20 | C22 | H221 | 109.0° | 109.5° |
| C20 | C22 | H222 | 109.0° | 109.4° |
| C22 | C23 | C25 | 108.5° | 109.4° |
| C22 | C23 | C24 | 112.2° | 109.4° |
| C23 | C22 | H221 | 109.0° | 109.5° |
| C23 | C22 | H222 | 109.0° | 109.5° |
| C22 | C23 | H231 | 108.8° | 109.5° |
| O29 | C28 | C04 | 120.5° | 120.0° |
| C28 | O29 | H1 | 109.5° | 117.0° |
| C28 | C04 | C03 | 122.5° | 120.2° |
| C28 | C04 | C05 | 119.8° | 120.2° |
| C19 | C20 | C21 | 110.2° | 109.5° |
| C20 | C19 | C18 | 113.1° | 109.5° |
| C20 | C19 | H191 | 108.6° | 109.4° |
| C20 | C19 | H192 | 108.6° | 109.4° |
| C19 | C20 | H201 | 112.4° | 109.5° |
| C20 | C21 | C16 | 111.8° | 109.5° |
| C21 | C20 | H201 | 111.3° | 109.5° |
| C20 | C21 | H211 | 108.8° | 109.5° |
| C20 | C21 | H212 | 108.9° | 109.5° |
| C19 | C18 | C25 | 112.4° | 109.5° |
| C19 | C18 | C17 | 109.7° | 109.5° |
| C19 | C18 | H181 | 112.2° | 109.4° |
| C18 | C19 | H191 | 108.6° | 109.5° |
| C18 | C19 | H192 | 108.6° | 109.5° |
| C25 | C23 | C24 | 108.1° | 109.5° |
| C23 | C25 | C18 | 110.5° | 109.5° |
| C25 | C23 | H231 | 108.1° | 109.5° |
| C23 | C25 | H251 | 109.2° | 109.4° |
| C23 | C25 | H252 | 109.2° | 109.5° |
| C23 | C24 | C16 | 113.3° | 109.5° |
| C24 | C23 | H231 | 111.0° | 109.5° |
| C23 | C24 | H242 | 108.5° | 109.5° |
| C23 | C24 | H241 | 108.5° | 109.5° |
| C12 | C13 | C08 | 123.5° | 119.9° |
| C13 | C12 | C11 | 120.0° | 120.1° |
| C13 | C12 | H121 | 120.0° | 120.0° |
| C12 | C13 | H131 | 118.3° | 120.1° |
| C13 | C08 | S07 | 117.4° | 120.1° |
| C13 | C08 | C09 | 118.0° | 119.8° |
| C08 | C13 | H131 | 118.3° | 120.0° |
| C12 | C11 | C10 | 116.1° | 120.1° |
| C12 | C11 | H111 | 122.0° | 119.9° |
| C11 | C12 | H121 | 120.0° | 119.9° |
| C21 | C16 | C24 | 109.3° | 109.5° |
| C21 | C16 | C17 | 109.0° | 109.5° |
| C21 | C16 | N15 | 109.3° | 109.5° |
| C16 | C21 | H211 | 108.9° | 109.5° |
| C16 | C21 | H212 | 108.9° | 109.5° |
| C03 | C04 | C05 | 117.7° | 119.6° |
| C04 | C03 | C02 | 120.4° | 119.9° |
| C04 | C03 | H031 | 119.8° | 120.1° |
| C04 | C05 | S07 | 111.1° | 120.2° |
| C04 | C05 | C06 | 123.5° | 119.6° |
| C03 | C02 | C01 | 123.0° | 120.4° |
| C03 | C02 | H021 | 118.5° | 119.8° |
| C02 | C03 | H031 | 119.8° | 120.1° |
| C25 | C18 | C17 | 98.6° | 109.5° |
| C25 | C18 | H181 | 111.7° | 109.4° |
| C18 | C25 | H251 | 109.2° | 109.5° |
| C18 | C25 | H252 | 109.2° | 109.5° |
| C08 | S07 | C05 | 93.7° | 103.0° |
| S07 | C08 | C09 | 124.4° | 120.1° |
| S07 | C05 | C06 | 125.3° | 120.2° |
| C24 | C16 | C17 | 108.8° | 109.5° |
| C24 | C16 | N15 | 110.1° | 109.5° |
| C16 | C24 | H242 | 108.5° | 109.5° |
| C16 | C24 | H241 | 108.5° | 109.4° |
| C08 | C09 | C10 | 122.7° | 119.9° |
| C08 | C09 | S14 | 118.9° | 120.0° |
| C11 | C10 | C09 | 119.5° | 120.1° |
| C11 | C10 | H101 | 120.3° | 119.9° |
| C10 | C11 | H111 | 121.9° | 120.0° |
| C18 | C17 | C16 | 112.1° | 109.5° |
| C18 | C17 | H171 | 108.8° | 109.5° |
| C18 | C17 | H172 | 108.8° | 109.5° |
| C17 | C18 | H181 | 111.4° | 109.5° |
| C05 | C06 | C01 | 118.8° | 120.0° |
| C05 | C06 | H061 | 120.6° | 120.0° |
| C17 | C16 | N15 | 110.3° | 109.5° |
| C16 | C17 | H171 | 108.8° | 109.4° |
| C16 | C17 | H172 | 108.8° | 109.4° |
| C16 | N15 | S14 | 127.4° | 120.0° |
| C16 | N15 | H151 | 104.8° | 120.1° |
| C02 | C01 | C06 | 116.6° | 120.5° |
| C02 | C01 | H011 | 121.7° | 119.7° |
| C01 | C02 | H021 | 118.5° | 119.8° |
| C10 | C09 | S14 | 118.2° | 120.0° |
| C09 | C10 | H101 | 120.2° | 120.0° |
| C09 | S14 | N15 | 108.7° | 107.2° |
| C09 | S14 | O26 | 113.8° | 106.4° |
| C09 | S14 | O27 | 111.2° | 106.4° |
| N15 | S14 | O26 | 113.4° | 106.4° |
| N15 | S14 | O27 | 111.0° | 106.4° |
| S14 | N15 | H151 | 104.8° | 120.0° |
| C06 | C01 | H011 | 121.7° | 119.8° |
| C01 | C06 | H061 | 120.6° | 120.0° |
| O26 | S14 | O27 | 98.5° | 123.2° |
| H171 | C17 | H172 | 109.5° | 109.5° |
| H191 | C19 | H192 | 109.5° | 109.5° |
| H211 | C21 | H212 | 109.5° | 109.4° |
| H221 | C22 | H222 | 109.4° | 109.5° |
| H242 | C24 | H241 | 109.5° | 109.4° |
| H251 | C25 | H252 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O30 | C28 | O29 | C04 | 178.9° | 179.9° |
| O30 | C28 | C04 | C03 | 89.0° | 174.5° |
| O30 | C28 | C04 | C05 | 92.4° | 5.6° |
| O30 | C28 | O29 | H1 | 0.0° | 0.0° |
| C20 | C22 | C23 | H221 | 120.3° | 120.0° |
| C20 | C22 | C23 | H222 | 120.3° | 120.0° |
| C22 | C20 | C19 | C21 | 108.4° | 119.9° |
| C22 | C20 | C19 | H201 | 126.8° | 120.0° |
| C22 | C20 | C21 | H201 | 117.2° | 120.0° |
| C22 | C20 | C19 | C18 | 52.5° | 60.0° |
| C20 | C22 | C23 | C25 | 57.7° | 60.0° |
| C20 | C22 | C23 | C24 | 61.7° | 60.0° |
| C22 | C20 | C21 | C16 | 61.6° | 60.0° |
| C22 | C20 | C19 | H191 | 173.0° | 60.0° |
| C22 | C20 | C19 | H192 | 68.1° | 180.0° |
| C22 | C20 | C21 | H211 | 58.7° | 180.0° |
| C22 | C20 | C21 | H212 | 178.0° | 60.1° |
| C20 | C22 | H221 | H222 | 119.2° | 119.9° |
| C20 | C22 | C23 | H231 | 175.0° | 180.0° |
| C23 | C22 | C20 | C19 | 56.3° | 60.0° |
| C23 | C22 | C20 | C21 | 59.6° | 60.0° |
| C22 | C23 | C25 | C24 | 122.0° | 120.0° |
| C22 | C23 | C25 | H231 | 117.8° | 120.0° |
| C22 | C23 | C24 | H231 | 122.0° | 120.0° |
| C22 | C23 | C25 | C18 | 57.0° | 60.0° |
| C22 | C23 | C24 | C16 | 57.7° | 60.0° |
| C23 | C22 | C20 | H201 | 176.5° | 180.0° |
| C23 | C22 | H221 | H222 | 119.2° | 120.0° |
| C22 | C23 | C24 | H242 | 178.3° | 60.1° |
| C22 | C23 | C24 | H241 | 62.9° | 180.0° |
| C22 | C23 | C25 | H251 | 63.1° | 180.0° |
| C22 | C23 | C25 | H252 | 177.2° | 60.0° |
| O29 | C28 | C04 | C03 | 92.1° | 5.5° |
| O29 | C28 | C04 | C05 | 86.5° | 174.5° |
| C28 | C04 | C03 | C05 | 178.7° | 179.9° |
| C28 | C04 | C03 | C02 | 179.3° | 179.9° |
| C28 | C04 | C05 | S07 | 2.0° | 0.0° |
| C28 | C04 | C05 | C06 | 179.5° | 179.8° |
| C28 | C04 | C03 | H031 | 0.7° | 0.0° |
| C04 | C28 | O29 | H1 | 178.9° | 180.0° |
| C19 | C20 | C21 | H201 | 125.4° | 120.0° |
| C20 | C19 | C18 | H191 | 120.5° | 120.0° |
| C20 | C19 | C18 | H192 | 120.5° | 120.0° |
| C19 | C20 | C21 | C16 | 55.7° | 60.0° |
| C20 | C19 | C18 | C25 | 52.4° | 60.0° |
| C20 | C19 | C18 | C17 | 56.3° | 60.0° |
| C20 | C19 | C18 | H181 | 179.3° | 180.0° |
| C20 | C19 | H191 | H192 | 118.4° | 119.9° |
| C19 | C20 | C21 | H211 | 176.1° | 60.1° |
| C19 | C20 | C21 | H212 | 64.6° | 180.0° |
| C19 | C20 | C22 | H221 | 64.0° | 60.0° |
| C19 | C20 | C22 | H222 | 176.6° | 180.0° |
| C21 | C20 | C19 | C18 | 56.0° | 60.0° |
| C20 | C21 | C16 | H211 | 120.3° | 120.0° |
| C20 | C21 | C16 | H212 | 120.4° | 120.0° |
| C20 | C21 | C16 | C24 | 63.1° | 60.0° |
| C20 | C21 | C16 | C17 | 55.7° | 60.0° |
| C20 | C21 | C16 | N15 | 176.3° | 180.0° |
| C21 | C20 | C19 | H191 | 64.6° | 180.0° |
| C21 | C20 | C19 | H192 | 176.5° | 60.0° |
| C20 | C21 | H211 | H212 | 118.9° | 120.0° |
| C21 | C20 | C22 | H221 | 179.8° | 180.0° |
| C21 | C20 | C22 | H222 | 60.7° | 60.1° |
| C19 | C18 | C25 | C23 | 54.4° | 60.0° |
| C19 | C18 | C25 | C17 | 115.6° | 120.0° |
| C19 | C18 | C25 | H181 | 127.2° | 119.9° |
| C19 | C18 | C17 | H181 | 124.9° | 120.0° |
| C19 | C18 | C17 | C16 | 56.4° | 60.0° |
| C19 | C18 | C17 | H171 | 64.0° | 180.0° |
| C19 | C18 | C17 | H172 | 176.8° | 60.0° |
| C18 | C19 | H191 | H192 | 118.4° | 120.1° |
| C18 | C19 | C20 | H201 | 179.3° | 180.0° |
| C19 | C18 | C25 | H251 | 65.7° | 180.0° |
| C19 | C18 | C25 | H252 | 174.6° | 60.0° |
| C25 | C23 | C24 | H231 | 118.4° | 120.0° |
| C23 | C25 | C18 | H251 | 120.1° | 120.0° |
| C23 | C25 | C18 | H252 | 120.2° | 120.0° |
| C25 | C23 | C24 | C16 | 62.0° | 59.9° |
| C23 | C25 | C18 | C17 | 61.1° | 60.0° |
| C23 | C25 | C18 | H181 | 178.3° | 180.0° |
| C25 | C23 | C22 | H221 | 62.6° | 60.0° |
| C25 | C23 | C22 | H222 | 178.0° | 180.0° |
| C25 | C23 | C24 | H242 | 58.6° | 180.0° |
| C25 | C23 | C24 | H241 | 177.4° | 60.0° |
| C23 | C25 | H251 | H252 | 119.6° | 120.0° |
| C23 | C24 | C16 | C21 | 57.6° | 60.0° |
| C24 | C23 | C25 | C18 | 64.9° | 59.9° |
| C23 | C24 | C16 | H242 | 120.6° | 120.1° |
| C23 | C24 | C16 | H241 | 120.6° | 120.0° |
| C23 | C24 | C16 | C17 | 61.3° | 60.0° |
| C23 | C24 | C16 | N15 | 177.7° | 180.0° |
| C24 | C23 | C22 | H221 | 178.0° | 180.0° |
| C24 | C23 | C22 | H222 | 58.6° | 60.0° |
| C23 | C24 | H242 | H241 | 118.2° | 120.0° |
| C24 | C23 | C25 | H251 | 174.9° | 60.1° |
| C24 | C23 | C25 | H252 | 55.2° | 180.0° |
| C12 | C13 | C08 | H131 | 180.0° | 180.0° |
| C13 | C12 | C11 | H121 | 180.0° | 179.9° |
| C12 | C13 | C08 | S07 | 179.3° | 179.7° |
| C12 | C13 | C08 | C09 | 5.9° | 0.0° |
| C13 | C12 | C11 | C10 | 1.1° | 0.0° |
| C13 | C12 | C11 | H111 | 178.9° | 180.0° |
| C08 | C13 | C12 | C11 | 3.5° | 0.0° |
| C13 | C08 | S07 | C09 | 174.5° | 179.8° |
| C13 | C08 | S07 | C05 | 66.8° | 66.3° |
| C13 | C08 | C09 | C10 | 6.2° | 0.0° |
| C13 | C08 | C09 | S14 | 179.6° | 180.0° |
| C08 | C13 | C12 | H121 | 176.6° | 180.0° |
| C12 | C11 | C10 | H111 | 180.0° | 180.0° |
| C12 | C11 | C10 | C09 | 1.4° | 0.0° |
| C12 | C11 | C10 | H101 | 178.6° | 180.0° |
| C11 | C12 | C13 | H131 | 176.5° | 180.0° |
| C21 | C16 | C24 | C17 | 118.9° | 120.0° |
| C21 | C16 | C24 | N15 | 120.1° | 120.0° |
| C21 | C16 | C17 | C18 | 56.4° | 60.0° |
| C21 | C16 | C17 | N15 | 120.0° | 120.0° |
| C21 | C16 | N15 | S14 | 61.3° | 54.2° |
| C21 | C16 | C17 | H171 | 64.0° | 180.0° |
| C21 | C16 | C17 | H172 | 176.8° | 60.0° |
| C16 | C21 | C20 | H201 | 178.9° | 180.0° |
| C16 | C21 | H211 | H212 | 118.9° | 120.0° |
| C21 | C16 | C24 | H242 | 178.2° | 60.1° |
| C21 | C16 | C24 | H241 | 63.0° | 180.0° |
| C21 | C16 | N15 | H151 | 176.3° | 125.9° |
| C04 | C03 | C02 | H031 | 180.0° | 180.0° |
| C03 | C04 | C05 | S07 | 179.3° | 180.0° |
| C03 | C04 | C05 | C06 | 1.8° | 0.2° |
| C04 | C03 | C02 | C01 | 0.4° | 0.0° |
| C04 | C03 | C02 | H021 | 179.6° | 180.0° |
| C05 | C04 | C03 | C02 | 0.6° | 0.0° |
| C04 | C05 | S07 | C08 | 117.9° | 174.2° |
| C04 | C05 | S07 | C06 | 177.4° | 179.8° |
| C04 | C05 | C06 | C01 | 1.8° | 0.5° |
| C05 | C04 | C03 | H031 | 179.3° | 180.0° |
| C04 | C05 | C06 | H061 | 178.2° | 180.0° |
| C03 | C02 | C01 | H021 | 180.0° | 180.0° |
| C03 | C02 | C01 | C06 | 0.3° | 0.3° |
| C03 | C02 | C01 | H011 | 179.7° | 179.9° |
| C25 | C18 | C17 | H181 | 117.5° | 120.0° |
| C25 | C18 | C17 | C16 | 61.2° | 60.0° |
| C25 | C18 | C17 | H171 | 178.4° | 60.0° |
| C25 | C18 | C17 | H172 | 59.1° | 180.0° |
| C25 | C18 | C19 | H191 | 172.9° | 59.9° |
| C25 | C18 | C19 | H192 | 68.1° | 180.0° |
| C18 | C25 | C23 | H231 | 174.8° | 180.0° |
| C18 | C25 | H251 | H252 | 119.5° | 120.0° |
| C08 | S07 | C05 | C06 | 59.6° | 6.0° |
| S07 | C08 | C09 | C10 | 179.4° | 179.7° |
| S07 | C08 | C09 | S14 | 5.2° | 0.3° |
| S07 | C08 | C13 | H131 | 0.7° | 0.3° |
| C05 | S07 | C08 | C09 | 107.6° | 113.5° |
| S07 | C05 | C06 | C01 | 179.0° | 179.7° |
| S07 | C05 | C06 | H061 | 1.0° | 0.2° |
| C24 | C16 | C17 | C18 | 62.7° | 60.0° |
| C24 | C16 | C17 | N15 | 120.9° | 120.0° |
| C24 | C16 | N15 | S14 | 178.6° | 65.9° |
| C24 | C16 | C17 | H171 | 177.0° | 60.0° |
| C24 | C16 | C17 | H172 | 57.7° | 180.0° |
| C24 | C16 | C21 | H211 | 57.2° | 180.0° |
| C24 | C16 | C21 | H212 | 176.5° | 60.0° |
| C16 | C24 | C23 | H231 | 179.6° | 180.0° |
| C16 | C24 | H242 | H241 | 118.3° | 119.9° |
| C24 | C16 | N15 | H151 | 56.3° | 114.1° |
| C08 | C09 | C10 | C11 | 4.1° | 0.0° |
| C08 | C09 | C10 | S14 | 174.2° | 180.0° |
| C08 | C09 | S14 | N15 | 40.3° | 63.7° |
| C08 | C09 | S14 | O26 | 167.7° | 49.8° |
| C08 | C09 | S14 | O27 | 82.1° | 177.2° |
| C08 | C09 | C10 | H101 | 175.9° | 179.9° |
| C09 | C08 | C13 | H131 | 174.1° | 180.0° |
| C11 | C10 | C09 | H101 | 180.0° | 180.0° |
| C11 | C10 | C09 | S14 | 178.3° | 180.0° |
| C10 | C11 | C12 | H121 | 178.9° | 179.9° |
| C18 | C17 | C16 | H171 | 120.4° | 120.0° |
| C18 | C17 | C16 | H172 | 120.4° | 120.0° |
| C18 | C17 | C16 | N15 | 176.5° | 180.0° |
| C18 | C17 | H171 | H172 | 118.8° | 120.0° |
| C17 | C18 | C19 | H191 | 64.3° | 180.0° |
| C17 | C18 | C19 | H192 | 176.8° | 60.0° |
| C17 | C18 | C25 | H251 | 178.7° | 60.0° |
| C17 | C18 | C25 | H252 | 59.0° | 180.0° |
| C05 | C06 | C01 | C02 | 0.8° | 0.5° |
| C05 | C06 | C01 | H061 | 180.0° | 179.5° |
| C05 | C06 | C01 | H011 | 179.3° | 179.8° |
| C17 | C16 | N15 | S14 | 58.6° | 174.1° |
| C16 | C17 | H171 | H172 | 118.8° | 120.0° |
| C16 | C17 | C18 | H181 | 178.7° | 180.0° |
| C17 | C16 | C21 | H211 | 176.0° | 60.0° |
| C17 | C16 | C21 | H212 | 64.7° | 180.0° |
| C17 | C16 | C24 | H242 | 59.3° | 180.0° |
| C17 | C16 | C24 | H241 | 178.1° | 60.0° |
| C17 | C16 | N15 | H151 | 63.8° | 5.9° |
| C16 | N15 | S14 | C09 | 69.1° | 62.8° |
| C16 | N15 | S14 | H151 | 122.3° | 180.0° |
| C16 | N15 | S14 | O26 | 58.5° | 176.4° |
| C16 | N15 | S14 | O27 | 168.3° | 50.7° |
| N15 | C16 | C17 | H171 | 56.1° | 60.0° |
| N15 | C16 | C17 | H172 | 63.2° | 60.0° |
| N15 | C16 | C21 | H211 | 63.3° | 59.9° |
| N15 | C16 | C21 | H212 | 56.0° | 60.0° |
| N15 | C16 | C24 | H242 | 61.7° | 60.0° |
| N15 | C16 | C24 | H241 | 57.1° | 60.0° |
| C02 | C01 | C06 | H011 | 180.0° | 179.7° |
| C01 | C02 | C03 | H031 | 179.7° | 180.0° |
| C02 | C01 | C06 | H061 | 179.3° | 180.0° |
| C10 | C09 | S14 | N15 | 134.1° | 116.4° |
| C10 | C09 | S14 | O26 | 6.7° | 130.1° |
| C10 | C09 | S14 | O27 | 103.4° | 2.9° |
| C09 | C10 | C11 | H111 | 178.6° | 180.0° |
| C09 | S14 | N15 | O26 | 127.6° | 113.6° |
| C09 | S14 | N15 | O27 | 122.6° | 113.5° |
| C09 | S14 | O26 | O27 | 117.8° | 123.0° |
| S14 | C09 | C10 | H101 | 1.7° | 0.0° |
| C09 | S14 | N15 | H151 | 168.6° | 117.2° |
| N15 | S14 | O26 | O27 | 117.3° | 122.9° |
| C06 | C01 | C02 | H021 | 179.7° | 179.7° |
| O26 | S14 | N15 | H151 | 63.8° | 3.6° |
| O27 | S14 | N15 | H151 | 46.0° | 129.3° |
| H011 | C01 | C02 | H021 | 0.3° | 0.1° |
| H011 | C01 | C06 | H061 | 0.7° | 0.3° |
| H021 | C02 | C03 | H031 | 0.4° | 0.0° |
| H101 | C10 | C11 | H111 | 1.4° | 0.0° |
| H111 | C11 | C12 | H121 | 1.1° | 0.0° |
| H121 | C12 | C13 | H131 | 3.5° | 0.0° |
| H171 | C17 | C18 | H181 | 60.9° | 60.0° |
| H172 | C17 | C18 | H181 | 58.3° | 60.0° |
| H181 | C18 | C19 | H191 | 60.1° | 60.0° |
| H181 | C18 | C19 | H192 | 58.8° | 60.1° |
| H181 | C18 | C25 | H251 | 61.5° | 60.1° |
| H181 | C18 | C25 | H252 | 58.2° | 59.9° |
| H191 | C19 | C20 | H201 | 60.2° | 60.0° |
| H192 | C19 | C20 | H201 | 58.8° | 60.0° |
| H201 | C20 | C21 | H211 | 58.5° | 60.0° |
| H201 | C20 | C21 | H212 | 60.8° | 60.0° |
| H201 | C20 | C22 | H221 | 63.2° | 60.0° |
| H201 | C20 | C22 | H222 | 56.2° | 60.0° |
| H221 | C22 | C23 | H231 | 54.8° | 60.0° |
| H222 | C22 | C23 | H231 | 64.7° | 60.0° |
| H231 | C23 | C24 | H242 | 59.8° | 60.0° |
| H231 | C23 | C24 | H241 | 59.0° | 60.0° |
| H231 | C23 | C25 | H251 | 54.7° | 60.0° |
| H231 | C23 | C25 | H252 | 65.1° | 60.0° |
