1TA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O26 | C20 | sing | 1.44Å | 1.42Å | |
| O26 | C23 | sing | 1.38Å | 1.41Å | |
| C24 | C23 | sing | 1.53Å | 1.55Å | |
| C25 | C23 | sing | 1.53Å | 1.55Å | |
| C20 | C19 | sing | 1.55Å | 1.56Å | |
| C20 | C21 | sing | 1.56Å | 1.58Å | |
| C23 | O22 | sing | 1.44Å | 1.44Å | |
| C19 | C18 | sing | 1.53Å | 1.56Å | |
| O30 | C27 | doub | 1.21Å | 1.22Å | |
| O22 | C21 | sing | 1.44Å | 1.41Å | |
| C09 | C08 | sing | 1.53Å | 1.59Å | |
| C09 | C10 | sing | 1.53Å | 1.54Å | |
| C21 | C27 | sing | 1.51Å | 1.57Å | |
| C21 | C16 | sing | 1.52Å | 1.64Å | |
| C18 | C10 | sing | 1.52Å | 1.61Å | |
| C18 | C16 | sing | 1.53Å | 1.55Å | |
| C27 | C28 | sing | 1.51Å | 1.54Å | |
| C08 | C07 | sing | 1.52Å | 1.56Å | |
| C10 | C11 | sing | 1.54Å | 1.60Å | |
| C16 | C17 | sing | 1.53Å | 1.54Å | |
| C16 | C15 | sing | 1.52Å | 1.55Å | |
| C28 | O29 | sing | 1.43Å | 1.40Å | |
| F12 | C11 | sing | 1.40Å | 1.34Å | |
| C07 | C31 | doub | 1.33Å | 1.36Å | |
| C07 | C05 | sing | 1.50Å | 1.54Å | |
| C11 | C05 | sing | 1.53Å | 1.67Å | |
| C11 | C13 | sing | 1.53Å | 1.61Å | |
| C15 | C13 | sing | 1.54Å | 1.59Å | |
| C31 | C02 | sing | 1.47Å | 1.51Å | |
| C05 | C06 | sing | 1.53Å | 1.55Å | |
| C05 | C04 | sing | 1.49Å | 1.55Å | |
| C13 | O14 | sing | 1.43Å | 1.39Å | |
| C02 | O01 | doub | 1.22Å | 1.22Å | |
| C02 | C03 | sing | 1.47Å | 1.49Å | |
| C04 | C03 | doub | 1.32Å | 1.32Å | |
| C03 | H031 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C06 | H063 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C17 | H173 | 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 | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.08Å | 1.08Å | |
| O14 | H141 | sing | 0.97Å | 0.95Å | |
| O29 | H291 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | O26 | C23 | 112.0° | 108.5° |
| O26 | C20 | C19 | 114.9° | 107.9° |
| O26 | C20 | C21 | 106.2° | 100.8° |
| O26 | C20 | H201 | 111.5° | 112.9° |
| O26 | C23 | C24 | 112.6° | 113.0° |
| O26 | C23 | C25 | 107.2° | 110.1° |
| O26 | C23 | O22 | 104.4° | 102.2° |
| C24 | C23 | C25 | 107.7° | 110.4° |
| C24 | C23 | O22 | 111.5° | 110.5° |
| C23 | C24 | H241 | 109.5° | 109.4° |
| C23 | C24 | H243 | 109.5° | 109.5° |
| C23 | C24 | H242 | 109.5° | 109.5° |
| C25 | C23 | O22 | 113.3° | 110.4° |
| C23 | C25 | H251 | 109.5° | 109.5° |
| C23 | C25 | H253 | 109.5° | 109.5° |
| C23 | C25 | H252 | 109.5° | 109.5° |
| C19 | C20 | C21 | 105.4° | 106.4° |
| C20 | C19 | C18 | 106.7° | 103.1° |
| C20 | C19 | H192 | 110.2° | 110.7° |
| C20 | C19 | H191 | 110.2° | 110.8° |
| C19 | C20 | H201 | 109.3° | 112.4° |
| C20 | C21 | O22 | 101.3° | 104.6° |
| C20 | C21 | C27 | 112.8° | 112.0° |
| C20 | C21 | C16 | 103.2° | 104.1° |
| C21 | C20 | H201 | 109.2° | 115.6° |
| C23 | O22 | C21 | 114.6° | 104.6° |
| C19 | C18 | C10 | 125.0° | 115.7° |
| C19 | C18 | C16 | 99.0° | 102.0° |
| C19 | C18 | H181 | 106.0° | 110.9° |
| C18 | C19 | H192 | 110.2° | 110.7° |
| C18 | C19 | H191 | 110.2° | 110.7° |
| O30 | C27 | C21 | 119.0° | 120.0° |
| O30 | C27 | C28 | 118.6° | 119.9° |
| O22 | C21 | C27 | 108.6° | 111.9° |
| O22 | C21 | C16 | 117.7° | 114.9° |
| C08 | C09 | C10 | 115.4° | 109.7° |
| C09 | C08 | C07 | 122.2° | 108.1° |
| C09 | C08 | H081 | 106.2° | 109.7° |
| C09 | C08 | H082 | 106.2° | 109.8° |
| C08 | C09 | H092 | 108.0° | 109.4° |
| C08 | C09 | H091 | 108.0° | 109.4° |
| C09 | C10 | C18 | 113.5° | 109.8° |
| C09 | C10 | C11 | 106.2° | 110.9° |
| C10 | C09 | H092 | 108.0° | 109.4° |
| C10 | C09 | H091 | 108.0° | 109.4° |
| C09 | C10 | H101 | 108.6° | 109.7° |
| C27 | C21 | C16 | 112.7° | 109.0° |
| C21 | C27 | C28 | 122.4° | 120.0° |
| C21 | C16 | C18 | 104.5° | 103.2° |
| C21 | C16 | C17 | 106.4° | 109.8° |
| C21 | C16 | C15 | 119.7° | 116.4° |
| C10 | C18 | C16 | 114.0° | 108.3° |
| C18 | C10 | C11 | 112.6° | 109.2° |
| C18 | C10 | H101 | 107.8° | 110.6° |
| C10 | C18 | H181 | 105.4° | 110.4° |
| C18 | C16 | C17 | 109.6° | 107.9° |
| C18 | C16 | C15 | 109.3° | 109.3° |
| C16 | C18 | H181 | 106.0° | 109.1° |
| C27 | C28 | O29 | 110.4° | 109.5° |
| C27 | C28 | H282 | 109.3° | 109.4° |
| C27 | C28 | H281 | 109.2° | 109.5° |
| C08 | C07 | C31 | 129.0° | 119.0° |
| C08 | C07 | C05 | 108.6° | 118.0° |
| C07 | C08 | H081 | 106.2° | 109.8° |
| C07 | C08 | H082 | 106.2° | 109.7° |
| C10 | C11 | F12 | 109.1° | 109.2° |
| C10 | C11 | C05 | 116.4° | 110.6° |
| C10 | C11 | C13 | 107.7° | 111.7° |
| C11 | C10 | H101 | 108.0° | 106.7° |
| C17 | C16 | C15 | 107.1° | 109.8° |
| C16 | C17 | H172 | 109.5° | 109.5° |
| C16 | C17 | H171 | 109.5° | 109.5° |
| C16 | C17 | H173 | 109.5° | 109.5° |
| C16 | C15 | C13 | 116.6° | 107.2° |
| C16 | C15 | H152 | 107.7° | 109.9° |
| C16 | C15 | H151 | 107.7° | 110.0° |
| O29 | C28 | H282 | 109.2° | 109.5° |
| O29 | C28 | H281 | 109.3° | 109.5° |
| C28 | O29 | H291 | 109.5° | 114.0° |
| F12 | C11 | C05 | 104.3° | 105.7° |
| F12 | C11 | C13 | 105.1° | 108.4° |
| C31 | C07 | C05 | 120.2° | 123.0° |
| C07 | C31 | C02 | 125.2° | 120.6° |
| C07 | C31 | H311 | 117.4° | 119.7° |
| C07 | C05 | C11 | 112.6° | 108.7° |
| C07 | C05 | C06 | 104.4° | 107.8° |
| C07 | C05 | C04 | 111.3° | 113.8° |
| C05 | C11 | C13 | 113.6° | 111.1° |
| C11 | C05 | C06 | 107.4° | 107.8° |
| C11 | C05 | C04 | 114.1° | 110.7° |
| C11 | C13 | C15 | 113.9° | 111.6° |
| C11 | C13 | O14 | 108.6° | 109.0° |
| C11 | C13 | H131 | 107.4° | 109.1° |
| C15 | C13 | O14 | 109.1° | 109.0° |
| C15 | C13 | H131 | 107.6° | 109.0° |
| C13 | C15 | H152 | 107.7° | 109.9° |
| C13 | C15 | H151 | 107.7° | 109.9° |
| C31 | C02 | O01 | 123.3° | 120.8° |
| C31 | C02 | C03 | 114.6° | 118.4° |
| C02 | C31 | H311 | 117.4° | 119.6° |
| C06 | C05 | C04 | 106.2° | 107.8° |
| C05 | C06 | H062 | 109.5° | 109.5° |
| C05 | C06 | H063 | 109.5° | 109.5° |
| C05 | C06 | H061 | 109.5° | 109.5° |
| C05 | C04 | C03 | 126.9° | 124.0° |
| C05 | C04 | H041 | 116.5° | 118.0° |
| O14 | C13 | H131 | 110.2° | 109.1° |
| C13 | O14 | H141 | 109.5° | 114.0° |
| O01 | C02 | C03 | 122.1° | 120.8° |
| C02 | C03 | C04 | 120.6° | 119.9° |
| C02 | C03 | H031 | 119.7° | 120.1° |
| C04 | C03 | H031 | 119.7° | 120.0° |
| C03 | C04 | H041 | 116.6° | 118.0° |
| H062 | C06 | H063 | 109.4° | 109.5° |
| H062 | C06 | H061 | 109.4° | 109.5° |
| H063 | C06 | H061 | 109.5° | 109.4° |
| H081 | C08 | H082 | 109.5° | 109.8° |
| H092 | C09 | H091 | 109.5° | 109.4° |
| H152 | C15 | H151 | 109.5° | 109.9° |
| H172 | C17 | H171 | 109.4° | 109.5° |
| H172 | C17 | H173 | 109.5° | 109.4° |
| H171 | C17 | H173 | 109.5° | 109.5° |
| H192 | C19 | H191 | 109.4° | 110.7° |
| H241 | C24 | H243 | 109.5° | 109.5° |
| H241 | C24 | H242 | 109.4° | 109.5° |
| H243 | C24 | H242 | 109.5° | 109.5° |
| H251 | C25 | H253 | 109.4° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.4° |
| H253 | C25 | H252 | 109.5° | 109.5° |
| H282 | C28 | H281 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | O26 | C23 | C24 | 109.7° | 75.2° |
| C20 | O26 | C23 | C25 | 132.0° | 160.8° |
| O26 | C20 | C19 | C21 | 116.5° | 107.4° |
| O26 | C20 | C19 | H201 | 126.2° | 125.1° |
| O26 | C20 | C21 | H201 | 120.3° | 122.0° |
| C20 | O26 | C23 | O22 | 11.4° | 43.6° |
| O26 | C20 | C19 | C18 | 89.6° | 87.8° |
| O26 | C20 | C21 | O22 | 1.1° | 0.1° |
| O26 | C20 | C21 | C27 | 114.8° | 121.3° |
| O26 | C20 | C21 | C16 | 123.4° | 121.1° |
| O26 | C20 | C19 | H192 | 30.0° | 153.8° |
| O26 | C20 | C19 | H191 | 150.8° | 30.6° |
| O26 | C23 | C24 | C25 | 118.0° | 123.9° |
| O26 | C23 | C24 | O22 | 117.0° | 113.8° |
| O26 | C23 | C25 | O22 | 114.7° | 112.1° |
| C23 | O26 | C20 | C19 | 122.6° | 138.0° |
| C23 | O26 | C20 | C21 | 6.6° | 26.8° |
| O26 | C23 | O22 | C21 | 12.6° | 42.0° |
| C23 | O26 | C20 | H201 | 112.2° | 97.2° |
| O26 | C23 | C24 | H241 | 180.0° | 56.7° |
| O26 | C23 | C24 | H243 | 60.0° | 63.3° |
| O26 | C23 | C24 | H242 | 60.0° | 176.6° |
| O26 | C23 | C25 | H251 | 180.0° | 172.1° |
| O26 | C23 | C25 | H253 | 60.0° | 67.9° |
| O26 | C23 | C25 | H252 | 60.0° | 52.2° |
| C24 | C23 | C25 | O22 | 123.8° | 122.4° |
| C24 | C23 | O22 | C21 | 109.3° | 78.5° |
| C23 | C24 | H241 | H243 | 120.0° | 120.0° |
| C23 | C24 | H241 | H242 | 120.0° | 120.0° |
| C23 | C24 | H243 | H242 | 120.0° | 120.0° |
| C24 | C23 | C25 | H251 | 58.5° | 62.3° |
| C24 | C23 | C25 | H253 | 61.4° | 57.6° |
| C24 | C23 | C25 | H252 | 178.6° | 177.7° |
| C25 | C23 | O22 | C21 | 129.0° | 159.1° |
| C25 | C23 | C24 | H241 | 62.0° | 179.5° |
| C25 | C23 | C24 | H243 | 178.0° | 60.5° |
| C25 | C23 | C24 | H242 | 58.0° | 59.5° |
| C23 | C25 | H251 | H253 | 120.0° | 120.0° |
| C23 | C25 | H251 | H252 | 120.0° | 120.0° |
| C23 | C25 | H253 | H252 | 120.0° | 120.1° |
| C19 | C20 | C21 | H201 | 117.3° | 125.5° |
| C20 | C19 | C18 | H192 | 119.6° | 118.4° |
| C20 | C19 | C18 | H191 | 119.6° | 118.6° |
| C19 | C20 | C21 | O22 | 121.2° | 112.3° |
| C19 | C20 | C21 | C27 | 122.9° | 126.3° |
| C19 | C20 | C21 | C16 | 1.0° | 8.6° |
| C20 | C19 | C18 | C10 | 171.9° | 157.5° |
| C20 | C19 | C18 | C16 | 44.1° | 40.3° |
| C20 | C19 | C18 | H181 | 65.6° | 75.8° |
| C20 | C19 | H192 | H191 | 121.3° | 123.3° |
| C20 | C21 | O22 | C23 | 8.5° | 25.1° |
| C21 | C20 | C19 | C18 | 26.9° | 19.6° |
| C20 | C21 | C27 | O30 | 21.8° | 26.6° |
| C20 | C21 | O22 | C27 | 119.0° | 121.4° |
| C20 | C21 | O22 | C16 | 111.6° | 113.5° |
| C20 | C21 | C27 | C16 | 116.4° | 114.6° |
| C20 | C21 | C16 | C18 | 28.4° | 33.7° |
| C20 | C21 | C27 | C28 | 158.7° | 153.4° |
| C20 | C21 | C16 | C17 | 87.5° | 81.1° |
| C20 | C21 | C16 | C15 | 151.0° | 153.3° |
| C21 | C20 | C19 | H192 | 146.5° | 98.8° |
| C21 | C20 | C19 | H191 | 92.7° | 138.0° |
| C23 | O22 | C21 | C27 | 110.5° | 96.3° |
| C23 | O22 | C21 | C16 | 120.1° | 138.6° |
| O22 | C23 | C24 | H241 | 63.0° | 57.1° |
| O22 | C23 | C24 | H243 | 57.0° | 177.1° |
| O22 | C23 | C24 | H242 | 177.1° | 62.9° |
| O22 | C23 | C25 | H251 | 65.3° | 60.1° |
| O22 | C23 | C25 | H253 | 174.7° | 180.0° |
| O22 | C23 | C25 | H252 | 54.8° | 59.9° |
| C19 | C18 | C10 | C09 | 60.4° | 64.3° |
| C19 | C18 | C16 | C21 | 43.6° | 46.6° |
| C19 | C18 | C10 | C16 | 121.4° | 113.7° |
| C19 | C18 | C10 | H181 | 122.8° | 127.0° |
| C19 | C18 | C16 | H181 | 109.6° | 117.4° |
| C19 | C18 | C10 | C11 | 178.9° | 174.0° |
| C19 | C18 | C16 | C17 | 70.1° | 69.6° |
| C19 | C18 | C16 | C15 | 172.8° | 171.1° |
| C19 | C18 | C10 | H101 | 59.9° | 56.9° |
| C18 | C19 | H192 | H191 | 121.3° | 123.1° |
| C18 | C19 | C20 | H201 | 144.1° | 147.1° |
| O30 | C27 | C21 | O22 | 133.3° | 143.7° |
| O30 | C27 | C21 | C28 | 179.5° | 180.0° |
| O30 | C27 | C21 | C16 | 94.5° | 88.0° |
| O30 | C27 | C28 | O29 | 21.2° | 5.2° |
| O30 | C27 | C28 | H282 | 99.0° | 125.2° |
| O30 | C27 | C28 | H281 | 141.3° | 114.9° |
| O22 | C21 | C27 | C16 | 132.2° | 128.3° |
| O22 | C21 | C16 | C18 | 82.1° | 80.1° |
| O22 | C21 | C27 | C28 | 47.2° | 36.3° |
| O22 | C21 | C16 | C17 | 162.0° | 165.1° |
| O22 | C21 | C16 | C15 | 40.5° | 39.5° |
| O22 | C21 | C20 | H201 | 121.4° | 122.1° |
| C08 | C09 | C10 | H092 | 120.9° | 120.0° |
| C08 | C09 | C10 | H091 | 120.9° | 120.1° |
| C08 | C09 | C10 | C18 | 170.1° | 178.4° |
| C09 | C08 | C07 | H081 | 121.8° | 119.7° |
| C09 | C08 | C07 | H082 | 121.7° | 119.7° |
| C08 | C09 | C10 | C11 | 45.8° | 60.8° |
| C09 | C08 | C07 | C31 | 120.5° | 127.6° |
| C09 | C08 | C07 | C05 | 42.3° | 54.2° |
| C09 | C08 | H081 | H082 | 114.2° | 120.7° |
| C08 | C09 | H092 | H091 | 117.3° | 119.9° |
| C08 | C09 | C10 | H101 | 70.0° | 56.8° |
| C09 | C10 | C18 | C11 | 120.7° | 121.8° |
| C09 | C10 | C18 | H101 | 120.3° | 121.2° |
| C09 | C10 | C18 | C16 | 178.2° | 177.9° |
| C10 | C09 | C08 | C07 | 45.4° | 55.1° |
| C09 | C10 | C11 | H101 | 116.3° | 119.4° |
| C09 | C10 | C11 | F12 | 64.3° | 56.2° |
| C09 | C10 | C11 | C05 | 53.3° | 59.6° |
| C09 | C10 | C11 | C13 | 177.9° | 176.1° |
| C10 | C09 | C08 | H081 | 167.1° | 64.6° |
| C10 | C09 | C08 | H082 | 76.4° | 174.8° |
| C10 | C09 | H092 | H091 | 117.3° | 119.9° |
| C09 | C10 | C18 | H181 | 62.4° | 62.7° |
| C27 | C21 | C16 | C18 | 150.4° | 153.3° |
| C27 | C21 | C16 | C17 | 34.5° | 38.6° |
| C27 | C21 | C16 | C15 | 87.0° | 87.0° |
| C21 | C27 | C28 | O29 | 158.4° | 174.8° |
| C27 | C21 | C20 | H201 | 5.6° | 0.8° |
| C21 | C27 | C28 | H282 | 81.5° | 54.8° |
| C21 | C27 | C28 | H281 | 38.2° | 65.1° |
| C21 | C16 | C18 | C10 | 178.5° | 169.1° |
| C21 | C16 | C18 | C17 | 113.7° | 116.2° |
| C21 | C16 | C18 | C15 | 129.2° | 124.5° |
| C16 | C21 | C27 | C28 | 85.0° | 92.0° |
| C21 | C16 | C17 | C15 | 129.2° | 129.3° |
| C21 | C16 | C15 | C13 | 169.8° | 179.9° |
| C21 | C16 | C15 | H152 | 69.2° | 60.4° |
| C21 | C16 | C15 | H151 | 48.8° | 60.7° |
| C21 | C16 | C17 | H172 | 180.0° | 159.8° |
| C21 | C16 | C17 | H171 | 60.0° | 39.8° |
| C21 | C16 | C17 | H173 | 60.0° | 80.3° |
| C21 | C16 | C18 | H181 | 66.0° | 70.8° |
| C16 | C21 | C20 | H201 | 116.3° | 116.9° |
| C10 | C18 | C16 | H181 | 115.5° | 120.1° |
| C18 | C10 | C11 | H101 | 118.9° | 119.5° |
| C10 | C18 | C16 | C17 | 64.8° | 52.9° |
| C10 | C18 | C16 | C15 | 52.3° | 66.5° |
| C18 | C10 | C11 | F12 | 60.5° | 64.9° |
| C18 | C10 | C11 | C05 | 178.1° | 179.3° |
| C18 | C10 | C11 | C13 | 53.0° | 55.0° |
| C18 | C10 | C09 | H092 | 69.0° | 58.4° |
| C18 | C10 | C09 | H091 | 49.3° | 61.5° |
| C10 | C18 | C19 | H192 | 68.5° | 39.1° |
| C10 | C18 | C19 | H191 | 52.3° | 83.9° |
| C16 | C18 | C10 | C11 | 57.5° | 60.3° |
| C18 | C16 | C17 | C15 | 118.4° | 119.0° |
| C18 | C16 | C15 | C13 | 49.5° | 63.6° |
| C16 | C18 | C10 | H101 | 61.5° | 56.8° |
| C18 | C16 | C15 | H152 | 170.5° | 55.9° |
| C18 | C16 | C15 | H151 | 71.5° | 177.0° |
| C18 | C16 | C17 | H172 | 67.6° | 48.1° |
| C18 | C16 | C17 | H171 | 52.4° | 71.9° |
| C18 | C16 | C17 | H173 | 172.4° | 168.0° |
| C16 | C18 | C19 | H192 | 163.7° | 78.1° |
| C16 | C18 | C19 | H191 | 75.5° | 158.8° |
| C27 | C28 | O29 | H282 | 120.2° | 120.0° |
| C27 | C28 | O29 | H281 | 120.1° | 120.1° |
| C27 | C28 | H282 | H281 | 119.6° | 119.9° |
| C27 | C28 | O29 | H291 | 9.4° | 179.9° |
| C08 | C07 | C31 | C05 | 161.1° | 178.0° |
| C08 | C07 | C05 | C11 | 44.4° | 52.9° |
| C08 | C07 | C31 | C02 | 162.8° | 178.5° |
| C08 | C07 | C05 | C06 | 71.9° | 63.7° |
| C08 | C07 | C05 | C04 | 174.0° | 176.7° |
| C07 | C08 | H081 | H082 | 114.3° | 120.6° |
| C07 | C08 | C09 | H092 | 166.2° | 175.2° |
| C07 | C08 | C09 | H091 | 75.5° | 64.9° |
| C08 | C07 | C31 | H311 | 17.2° | 1.0° |
| C10 | C11 | F12 | C05 | 125.0° | 119.0° |
| C10 | C11 | F12 | C13 | 115.2° | 121.9° |
| C10 | C11 | C05 | C07 | 56.1° | 52.8° |
| C10 | C11 | C05 | C13 | 125.9° | 124.6° |
| C10 | C11 | C13 | C15 | 49.7° | 54.3° |
| C10 | C11 | C05 | C06 | 58.2° | 63.8° |
| C10 | C11 | C05 | C04 | 175.7° | 178.5° |
| C10 | C11 | C13 | O14 | 72.0° | 66.2° |
| C11 | C10 | C09 | H092 | 166.7° | 179.1° |
| C11 | C10 | C09 | H091 | 75.0° | 59.2° |
| C10 | C11 | C13 | H131 | 168.8° | 174.8° |
| C11 | C10 | C18 | H181 | 58.3° | 59.1° |
| C17 | C16 | C15 | C13 | 69.1° | 54.6° |
| C17 | C16 | C15 | H152 | 51.9° | 174.0° |
| C17 | C16 | C15 | H151 | 169.9° | 64.9° |
| C16 | C17 | H172 | H171 | 120.0° | 120.1° |
| C16 | C17 | H172 | H173 | 120.0° | 119.9° |
| C16 | C17 | H171 | H173 | 120.0° | 120.0° |
| C17 | C16 | C18 | H181 | 179.7° | 173.0° |
| C16 | C15 | C13 | C11 | 50.7° | 57.6° |
| C16 | C15 | C13 | H152 | 121.0° | 119.5° |
| C16 | C15 | C13 | H151 | 121.0° | 119.5° |
| C16 | C15 | C13 | O14 | 70.8° | 63.0° |
| C16 | C15 | C13 | H131 | 169.7° | 178.1° |
| C16 | C15 | H152 | H151 | 116.8° | 121.2° |
| C15 | C16 | C17 | H172 | 50.9° | 70.9° |
| C15 | C16 | C17 | H171 | 170.8° | 169.1° |
| C15 | C16 | C17 | H173 | 69.2° | 49.0° |
| C15 | C16 | C18 | H181 | 63.2° | 53.7° |
| O29 | C28 | H282 | H281 | 119.6° | 120.0° |
| F12 | C11 | C05 | C07 | 64.1° | 65.3° |
| F12 | C11 | C05 | C13 | 113.9° | 117.4° |
| F12 | C11 | C13 | C15 | 66.5° | 66.1° |
| F12 | C11 | C05 | C06 | 178.4° | 178.1° |
| F12 | C11 | C05 | C04 | 64.1° | 60.4° |
| F12 | C11 | C13 | O14 | 171.8° | 173.4° |
| F12 | C11 | C10 | H101 | 179.4° | 175.7° |
| F12 | C11 | C13 | H131 | 52.6° | 54.4° |
| C31 | C07 | C05 | C11 | 120.2° | 129.1° |
| C07 | C31 | C02 | H311 | 180.0° | 177.5° |
| C31 | C07 | C05 | C06 | 123.6° | 114.4° |
| C31 | C07 | C05 | C04 | 9.4° | 5.3° |
| C07 | C31 | C02 | O01 | 173.9° | 179.4° |
| C07 | C31 | C02 | C03 | 6.1° | 0.2° |
| C31 | C07 | C08 | H081 | 1.3° | 112.7° |
| C31 | C07 | C08 | H082 | 117.8° | 8.0° |
| C07 | C05 | C11 | C06 | 114.4° | 116.6° |
| C07 | C05 | C11 | C04 | 128.2° | 125.7° |
| C07 | C05 | C11 | C13 | 177.9° | 177.4° |
| C05 | C07 | C31 | C02 | 1.7° | 3.5° |
| C07 | C05 | C06 | C04 | 117.7° | 123.3° |
| C07 | C05 | C04 | C03 | 11.1° | 3.6° |
| C07 | C05 | C04 | H041 | 168.9° | 176.4° |
| C07 | C05 | C06 | H062 | 180.0° | 49.7° |
| C07 | C05 | C06 | H063 | 60.0° | 70.3° |
| C07 | C05 | C06 | H061 | 60.0° | 169.8° |
| C05 | C07 | C08 | H081 | 164.1° | 65.4° |
| C05 | C07 | C08 | H082 | 79.4° | 173.9° |
| C05 | C07 | C31 | H311 | 178.3° | 179.1° |
| C05 | C11 | C13 | C15 | 179.9° | 178.2° |
| C11 | C05 | C06 | C04 | 122.5° | 119.5° |
| C05 | C11 | C13 | O14 | 58.4° | 57.7° |
| C11 | C05 | C04 | C03 | 117.7° | 126.4° |
| C11 | C05 | C04 | H041 | 62.3° | 53.6° |
| C11 | C05 | C06 | H062 | 60.2° | 166.9° |
| C11 | C05 | C06 | H063 | 179.8° | 46.8° |
| C11 | C05 | C06 | H061 | 59.7° | 73.1° |
| C05 | C11 | C10 | H101 | 63.0° | 59.8° |
| C05 | C11 | C13 | H131 | 60.8° | 61.3° |
| C11 | C13 | C15 | O14 | 121.5° | 120.5° |
| C11 | C13 | C15 | H131 | 118.9° | 120.5° |
| C13 | C11 | C05 | C06 | 67.7° | 60.8° |
| C13 | C11 | C05 | C04 | 49.8° | 57.0° |
| C11 | C13 | O14 | H131 | 117.4° | 119.0° |
| C13 | C11 | C10 | H101 | 65.8° | 64.4° |
| C11 | C13 | C15 | H152 | 171.7° | 61.9° |
| C11 | C13 | C15 | H151 | 70.3° | 177.1° |
| C11 | C13 | O14 | H141 | 180.0° | 180.0° |
| C15 | C13 | O14 | H131 | 117.9° | 118.9° |
| C13 | C15 | H152 | H151 | 116.8° | 121.0° |
| C15 | C13 | O14 | H141 | 55.3° | 57.9° |
| C31 | C02 | O01 | C03 | 179.9° | 179.6° |
| C31 | C02 | C03 | C04 | 4.9° | 1.8° |
| C31 | C02 | C03 | H031 | 175.1° | 178.1° |
| C06 | C05 | C04 | C03 | 124.1° | 116.0° |
| C06 | C05 | C04 | H041 | 55.9° | 64.0° |
| C05 | C06 | H062 | H063 | 120.0° | 120.0° |
| C05 | C06 | H062 | H061 | 120.0° | 120.0° |
| C05 | C06 | H063 | H061 | 120.0° | 120.0° |
| C05 | C04 | C03 | C02 | 4.0° | 0.4° |
| C05 | C04 | C03 | H041 | 180.0° | 180.0° |
| C05 | C04 | C03 | H031 | 176.0° | 179.7° |
| C04 | C05 | C06 | H062 | 62.3° | 73.6° |
| C04 | C05 | C06 | H063 | 57.7° | 166.3° |
| C04 | C05 | C06 | H061 | 177.7° | 46.4° |
| O14 | C13 | C15 | H152 | 50.2° | 177.6° |
| O14 | C13 | C15 | H151 | 168.2° | 56.6° |
| O01 | C02 | C03 | C04 | 175.1° | 177.9° |
| O01 | C02 | C03 | H031 | 4.9° | 2.2° |
| O01 | C02 | C31 | H311 | 6.1° | 3.1° |
| C02 | C03 | C04 | H031 | 180.0° | 179.9° |
| C02 | C03 | C04 | H041 | 176.0° | 179.6° |
| C03 | C02 | C31 | H311 | 174.0° | 177.3° |
| H031 | C03 | C04 | H041 | 4.0° | 0.3° |
| H062 | C06 | H063 | H061 | 120.0° | 120.0° |
| H081 | C08 | C09 | H092 | 72.0° | 55.5° |
| H081 | C08 | C09 | H091 | 46.3° | 175.4° |
| H082 | C08 | C09 | H092 | 44.4° | 65.2° |
| H082 | C08 | C09 | H091 | 162.7° | 54.7° |
| H092 | C09 | C10 | H101 | 50.8° | 63.3° |
| H091 | C09 | C10 | H101 | 169.1° | 176.8° |
| H101 | C10 | C18 | H181 | 177.3° | 176.1° |
| H131 | C13 | C15 | H152 | 69.3° | 58.6° |
| H131 | C13 | C15 | H151 | 48.6° | 62.4° |
| H131 | C13 | O14 | H141 | 62.6° | 61.0° |
| H172 | C17 | H171 | H173 | 120.0° | 119.9° |
| H181 | C18 | C19 | H192 | 54.0° | 165.8° |
| H181 | C18 | C19 | H191 | 174.8° | 42.7° |
| H192 | C19 | C20 | H201 | 96.3° | 28.7° |
| H191 | C19 | C20 | H201 | 24.6° | 94.5° |
| H241 | C24 | H243 | H242 | 120.0° | 120.0° |
| H251 | C25 | H253 | H252 | 120.0° | 120.0° |
| H282 | C28 | O29 | H291 | 110.8° | 60.1° |
| H281 | C28 | O29 | H291 | 129.5° | 59.9° |
