TUA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O04 | C20 | doub | 1.21Å | 1.23Å | |
| C18 | C13 | sing | 1.53Å | 1.52Å | |
| O05 | C21 | sing | 1.43Å | 1.39Å | |
| C20 | C21 | sing | 1.51Å | 1.56Å | |
| C20 | C17 | sing | 1.51Å | 1.54Å | |
| C19 | C10 | sing | 1.53Å | 1.53Å | |
| O02 | C11 | sing | 1.43Å | 1.36Å | |
| C15 | C16 | sing | 1.55Å | 1.55Å | |
| C15 | C14 | sing | 1.53Å | 1.62Å | |
| C16 | C17 | sing | 1.58Å | 1.59Å | |
| C13 | C17 | sing | 1.52Å | 1.63Å | |
| C13 | C14 | sing | 1.57Å | 1.47Å | |
| C13 | C12 | sing | 1.52Å | 1.53Å | |
| C17 | O03 | sing | 1.43Å | 1.40Å | |
| C08 | C14 | sing | 1.52Å | 1.55Å | |
| C08 | C07 | sing | 1.53Å | 1.53Å | |
| C08 | C09 | sing | 1.54Å | 1.56Å | |
| C06 | C07 | sing | 1.53Å | 1.53Å | |
| C06 | C05 | sing | 1.52Å | 1.60Å | |
| C11 | C12 | sing | 1.54Å | 1.61Å | |
| C11 | C09 | sing | 1.53Å | 1.59Å | |
| C10 | C09 | sing | 1.53Å | 1.59Å | |
| C10 | C05 | sing | 1.50Å | 1.59Å | |
| C10 | C01 | sing | 1.49Å | 1.56Å | |
| C05 | C04 | doub | 1.33Å | 1.36Å | |
| C01 | C02 | doub | 1.32Å | 1.29Å | |
| C04 | C03 | sing | 1.47Å | 1.51Å | |
| C02 | C03 | sing | 1.47Å | 1.49Å | |
| C03 | O01 | doub | 1.22Å | 1.22Å | |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C02 | H021 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C06 | H072 | sing | 1.09Å | 1.10Å | |
| C06 | H071 | sing | 1.09Å | 1.10Å | |
| C07 | H082 | sing | 1.09Å | 1.10Å | |
| C07 | H081 | sing | 1.09Å | 1.10Å | |
| C08 | H211 | sing | 1.09Å | 1.10Å | |
| C09 | H221 | sing | 1.09Å | 1.10Å | |
| C11 | H231 | sing | 1.09Å | 1.10Å | |
| C12 | H092 | sing | 1.09Å | 1.10Å | |
| C12 | H091 | sing | 1.09Å | 1.10Å | |
| C14 | H111 | sing | 1.09Å | 1.10Å | |
| C15 | H121 | sing | 1.09Å | 1.10Å | |
| C15 | H122 | sing | 1.09Å | 1.10Å | |
| C16 | H132 | sing | 1.09Å | 1.10Å | |
| C16 | H131 | sing | 1.09Å | 1.10Å | |
| C18 | H203 | sing | 1.09Å | 1.10Å | |
| C18 | H202 | sing | 1.09Å | 1.10Å | |
| C18 | H201 | sing | 1.09Å | 1.10Å | |
| C19 | H263 | sing | 1.09Å | 1.10Å | |
| C19 | H261 | sing | 1.09Å | 1.10Å | |
| C19 | H262 | sing | 1.09Å | 1.10Å | |
| C21 | H152 | sing | 1.09Å | 1.10Å | |
| C21 | H151 | sing | 1.09Å | 1.10Å | |
| O02 | H241 | sing | 0.97Å | 0.95Å | |
| O03 | H191 | sing | 0.97Å | 0.95Å | |
| O05 | H171 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O04 | C20 | C21 | 118.9° | 120.1° |
| O04 | C20 | C17 | 119.0° | 119.9° |
| C18 | C13 | C17 | 109.2° | 109.8° |
| C18 | C13 | C14 | 113.5° | 109.8° |
| C18 | C13 | C12 | 110.5° | 110.6° |
| C13 | C18 | H203 | 109.5° | 109.5° |
| C13 | C18 | H202 | 109.5° | 109.4° |
| C13 | C18 | H201 | 109.4° | 109.5° |
| O05 | C21 | C20 | 112.7° | 109.4° |
| O05 | C21 | H152 | 108.7° | 109.5° |
| O05 | C21 | H151 | 108.7° | 109.5° |
| C21 | O05 | H171 | 109.5° | 114.0° |
| C21 | C20 | C17 | 122.1° | 120.0° |
| C20 | C21 | H152 | 108.7° | 109.4° |
| C20 | C21 | H151 | 108.7° | 109.5° |
| C20 | C17 | C16 | 116.1° | 111.2° |
| C20 | C17 | C13 | 108.8° | 110.3° |
| C20 | C17 | O03 | 106.4° | 110.3° |
| C19 | C10 | C09 | 107.2° | 107.7° |
| C19 | C10 | C05 | 102.4° | 107.5° |
| C19 | C10 | C01 | 106.9° | 106.8° |
| C10 | C19 | H263 | 109.5° | 109.5° |
| C10 | C19 | H261 | 109.5° | 109.5° |
| C10 | C19 | H262 | 109.5° | 109.4° |
| O02 | C11 | C12 | 109.4° | 109.0° |
| O02 | C11 | C09 | 113.7° | 109.0° |
| O02 | C11 | H231 | 109.8° | 109.0° |
| C11 | O02 | H241 | 109.5° | 114.0° |
| C16 | C15 | C14 | 105.9° | 102.9° |
| C15 | C16 | C17 | 104.5° | 106.1° |
| C16 | C15 | H121 | 110.4° | 110.7° |
| C16 | C15 | H122 | 110.4° | 110.7° |
| C15 | C16 | H132 | 110.7° | 110.1° |
| C15 | C16 | H131 | 110.7° | 110.1° |
| C15 | C14 | C13 | 104.3° | 101.6° |
| C15 | C14 | C08 | 118.3° | 115.8° |
| C15 | C14 | H111 | 103.5° | 111.0° |
| C14 | C15 | H121 | 110.3° | 112.3° |
| C14 | C15 | H122 | 110.3° | 109.2° |
| C16 | C17 | C13 | 104.6° | 104.9° |
| C16 | C17 | O03 | 110.8° | 109.7° |
| C17 | C16 | H132 | 110.7° | 108.6° |
| C17 | C16 | H131 | 110.7° | 111.7° |
| C17 | C13 | C14 | 101.0° | 103.3° |
| C17 | C13 | C12 | 116.3° | 116.0° |
| C13 | C17 | O03 | 110.0° | 110.3° |
| C14 | C13 | C12 | 106.1° | 106.9° |
| C13 | C14 | C08 | 119.8° | 106.2° |
| C13 | C14 | H111 | 104.9° | 111.6° |
| C13 | C12 | C11 | 114.4° | 107.2° |
| C13 | C12 | H092 | 108.2° | 109.9° |
| C13 | C12 | H091 | 108.2° | 110.0° |
| C17 | O03 | H191 | 109.5° | 114.0° |
| C14 | C08 | C07 | 110.7° | 109.9° |
| C14 | C08 | C09 | 108.5° | 107.4° |
| C14 | C08 | H211 | 109.3° | 109.8° |
| C08 | C14 | H111 | 104.1° | 110.3° |
| C07 | C08 | C09 | 109.4° | 109.6° |
| C08 | C07 | C06 | 111.7° | 109.7° |
| C08 | C07 | H082 | 108.9° | 109.5° |
| C08 | C07 | H081 | 108.9° | 109.4° |
| C07 | C08 | H211 | 109.6° | 109.7° |
| C08 | C09 | C11 | 113.5° | 111.7° |
| C08 | C09 | C10 | 112.0° | 109.0° |
| C09 | C08 | H211 | 109.2° | 110.4° |
| C08 | C09 | H221 | 105.2° | 109.2° |
| C07 | C06 | C05 | 118.6° | 108.1° |
| C07 | C06 | H072 | 107.1° | 109.7° |
| C07 | C06 | H071 | 107.1° | 109.7° |
| C06 | C07 | H082 | 108.9° | 109.5° |
| C06 | C07 | H081 | 108.9° | 109.4° |
| C06 | C05 | C10 | 111.6° | 118.0° |
| C06 | C05 | C04 | 125.9° | 118.9° |
| C05 | C06 | H072 | 107.2° | 109.7° |
| C05 | C06 | H071 | 107.2° | 109.7° |
| C12 | C11 | C09 | 110.3° | 111.6° |
| C12 | C11 | H231 | 106.6° | 109.1° |
| C11 | C12 | H092 | 108.2° | 109.9° |
| C11 | C12 | H091 | 108.2° | 109.9° |
| C11 | C09 | C10 | 115.2° | 108.6° |
| C11 | C09 | H221 | 104.9° | 109.2° |
| C09 | C11 | H231 | 106.8° | 109.1° |
| C09 | C10 | C05 | 115.7° | 109.6° |
| C09 | C10 | C01 | 113.6° | 111.0° |
| C10 | C09 | H221 | 104.9° | 109.1° |
| C05 | C10 | C01 | 110.1° | 113.9° |
| C10 | C05 | C04 | 119.0° | 123.0° |
| C10 | C01 | C02 | 127.7° | 124.0° |
| C10 | C01 | H011 | 116.1° | 118.0° |
| C05 | C04 | C03 | 127.2° | 120.5° |
| C05 | C04 | H041 | 116.4° | 119.7° |
| C01 | C02 | C03 | 122.1° | 119.9° |
| C02 | C01 | H011 | 116.1° | 118.0° |
| C01 | C02 | H021 | 118.9° | 120.0° |
| C04 | C03 | C02 | 113.0° | 118.5° |
| C04 | C03 | O01 | 123.3° | 120.7° |
| C03 | C04 | H041 | 116.4° | 119.8° |
| C02 | C03 | O01 | 123.8° | 120.8° |
| C03 | C02 | H021 | 118.9° | 120.1° |
| H072 | C06 | H071 | 109.5° | 109.8° |
| H082 | C07 | H081 | 109.5° | 109.5° |
| H092 | C12 | H091 | 109.5° | 109.8° |
| H121 | C15 | H122 | 109.5° | 110.8° |
| H132 | C16 | H131 | 109.5° | 110.1° |
| H203 | C18 | H202 | 109.4° | 109.4° |
| H203 | C18 | H201 | 109.5° | 109.5° |
| H202 | C18 | H201 | 109.5° | 109.5° |
| H263 | C19 | H261 | 109.4° | 109.5° |
| H263 | C19 | H262 | 109.4° | 109.5° |
| H261 | C19 | H262 | 109.5° | 109.5° |
| H152 | C21 | H151 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O04 | C20 | C21 | O05 | 19.5° | 0.0° |
| O04 | C20 | C21 | C17 | 178.7° | 180.0° |
| O04 | C20 | C17 | C16 | 21.4° | 25.7° |
| O04 | C20 | C17 | C13 | 96.2° | 90.3° |
| O04 | C20 | C17 | O03 | 145.3° | 147.6° |
| O04 | C20 | C21 | H152 | 140.0° | 120.0° |
| O04 | C20 | C21 | H151 | 101.0° | 120.0° |
| C18 | C13 | C17 | C20 | 44.9° | 31.1° |
| C18 | C13 | C14 | C15 | 73.1° | 72.3° |
| C18 | C13 | C17 | C16 | 79.8° | 88.8° |
| C18 | C13 | C17 | C14 | 119.8° | 117.1° |
| C18 | C13 | C17 | C12 | 125.9° | 126.3° |
| C18 | C13 | C14 | C12 | 121.6° | 120.0° |
| C18 | C13 | C17 | O03 | 161.1° | 153.1° |
| C18 | C13 | C14 | C08 | 62.1° | 49.2° |
| C18 | C13 | C12 | C11 | 68.1° | 54.4° |
| C18 | C13 | C12 | H092 | 52.6° | 173.8° |
| C18 | C13 | C12 | H091 | 171.2° | 65.1° |
| C18 | C13 | C14 | H111 | 178.4° | 169.5° |
| C13 | C18 | H203 | H202 | 120.0° | 119.9° |
| C13 | C18 | H203 | H201 | 120.0° | 120.1° |
| C13 | C18 | H202 | H201 | 120.0° | 120.1° |
| O05 | C21 | C20 | H152 | 120.5° | 119.9° |
| O05 | C21 | C20 | H151 | 120.5° | 120.0° |
| O05 | C21 | C20 | C17 | 159.2° | 180.0° |
| O05 | C21 | H152 | H151 | 118.5° | 120.1° |
| C21 | C20 | C17 | C16 | 159.9° | 154.3° |
| C21 | C20 | C17 | C13 | 82.5° | 89.7° |
| C21 | C20 | C17 | O03 | 36.0° | 32.4° |
| C20 | C21 | H152 | H151 | 118.6° | 120.0° |
| C20 | C21 | O05 | H171 | 8.6° | 180.0° |
| C20 | C17 | C16 | C15 | 139.1° | 121.2° |
| C20 | C17 | C16 | C13 | 120.0° | 119.3° |
| C20 | C17 | C16 | O03 | 121.6° | 122.3° |
| C20 | C17 | C13 | O03 | 116.2° | 122.1° |
| C20 | C17 | C13 | C14 | 164.7° | 148.1° |
| C20 | C17 | C13 | C12 | 81.0° | 95.3° |
| C20 | C17 | C16 | H132 | 19.9° | 2.9° |
| C20 | C17 | C16 | H131 | 101.7° | 118.7° |
| C17 | C20 | C21 | H152 | 38.8° | 60.1° |
| C17 | C20 | C21 | H151 | 80.3° | 59.9° |
| C20 | C17 | O03 | H191 | 180.0° | 57.9° |
| C19 | C10 | C09 | C08 | 65.7° | 62.3° |
| C19 | C10 | C05 | C06 | 82.7° | 65.2° |
| C19 | C10 | C09 | C11 | 65.9° | 59.6° |
| C19 | C10 | C09 | C05 | 113.4° | 116.7° |
| C19 | C10 | C09 | C01 | 117.8° | 116.6° |
| C19 | C10 | C05 | C01 | 113.4° | 118.2° |
| C19 | C10 | C05 | C04 | 117.3° | 114.9° |
| C19 | C10 | C01 | C02 | 112.2° | 115.7° |
| C19 | C10 | C01 | H011 | 67.8° | 64.7° |
| C19 | C10 | C09 | H221 | 179.3° | 178.5° |
| C10 | C19 | H263 | H261 | 120.0° | 120.0° |
| C10 | C19 | H263 | H262 | 120.0° | 120.0° |
| C10 | C19 | H261 | H262 | 120.0° | 119.9° |
| O02 | C11 | C12 | C13 | 73.5° | 63.1° |
| O02 | C11 | C09 | C08 | 76.2° | 66.4° |
| O02 | C11 | C12 | C09 | 125.8° | 120.5° |
| O02 | C11 | C12 | H231 | 118.6° | 118.9° |
| O02 | C11 | C09 | H231 | 121.2° | 118.9° |
| O02 | C11 | C09 | C10 | 54.8° | 53.9° |
| O02 | C11 | C09 | H221 | 169.6° | 172.7° |
| O02 | C11 | C12 | H092 | 47.2° | 177.5° |
| O02 | C11 | C12 | H091 | 165.7° | 56.5° |
| C16 | C15 | C14 | H121 | 119.4° | 119.1° |
| C16 | C15 | C14 | H122 | 119.4° | 117.6° |
| C15 | C16 | C17 | H132 | 119.2° | 118.3° |
| C15 | C16 | C17 | H131 | 119.2° | 120.1° |
| C15 | C16 | C17 | C13 | 19.1° | 1.9° |
| C16 | C15 | C14 | C13 | 33.2° | 42.9° |
| C15 | C16 | C17 | O03 | 99.3° | 116.5° |
| C16 | C15 | C14 | C08 | 169.2° | 157.4° |
| C16 | C15 | C14 | H111 | 76.4° | 75.8° |
| C16 | C15 | H121 | H122 | 121.7° | 123.2° |
| C15 | C16 | H132 | H131 | 122.3° | 121.6° |
| C14 | C15 | C16 | C17 | 6.6° | 25.8° |
| C15 | C14 | C13 | C17 | 43.6° | 44.8° |
| C15 | C14 | C13 | C08 | 135.2° | 121.5° |
| C15 | C14 | C13 | H111 | 108.5° | 118.3° |
| C15 | C14 | C13 | C12 | 165.4° | 167.7° |
| C15 | C14 | C08 | H111 | 114.1° | 127.1° |
| C15 | C14 | C08 | C07 | 54.5° | 64.0° |
| C15 | C14 | C08 | C09 | 174.6° | 176.8° |
| C15 | C14 | C08 | H211 | 66.3° | 56.7° |
| C14 | C15 | H121 | H122 | 121.6° | 122.3° |
| C14 | C15 | C16 | H132 | 125.8° | 143.2° |
| C14 | C15 | C16 | H131 | 112.6° | 95.3° |
| C16 | C17 | C13 | O03 | 119.1° | 118.0° |
| C16 | C17 | C13 | C14 | 40.0° | 28.2° |
| C16 | C17 | C13 | C12 | 154.3° | 144.9° |
| C17 | C16 | C15 | H121 | 126.1° | 94.4° |
| C17 | C16 | C15 | H122 | 112.8° | 142.3° |
| C17 | C16 | H132 | H131 | 122.3° | 122.6° |
| C16 | C17 | O03 | H191 | 52.9° | 64.9° |
| C17 | C13 | C14 | C12 | 121.8° | 122.9° |
| C17 | C13 | C14 | C08 | 178.8° | 166.2° |
| C17 | C13 | C12 | C11 | 166.7° | 179.7° |
| C17 | C13 | C12 | H092 | 72.6° | 60.3° |
| C17 | C13 | C12 | H091 | 46.0° | 60.8° |
| C17 | C13 | C14 | H111 | 64.9° | 73.5° |
| C13 | C17 | C16 | H132 | 100.1° | 116.4° |
| C13 | C17 | C16 | H131 | 138.4° | 122.0° |
| C17 | C13 | C18 | H203 | 180.0° | 75.4° |
| C17 | C13 | C18 | H202 | 60.0° | 164.7° |
| C17 | C13 | C18 | H201 | 60.0° | 44.6° |
| C13 | C17 | O03 | H191 | 62.3° | 180.0° |
| C14 | C13 | C17 | O03 | 79.1° | 89.8° |
| C13 | C14 | C08 | H111 | 116.7° | 121.1° |
| C13 | C14 | C08 | C07 | 176.2° | 175.8° |
| C13 | C14 | C08 | C09 | 56.2° | 65.0° |
| C14 | C13 | C12 | C11 | 55.4° | 65.1° |
| C13 | C14 | C08 | H211 | 62.9° | 55.1° |
| C14 | C13 | C12 | H092 | 176.1° | 54.3° |
| C14 | C13 | C12 | H091 | 65.4° | 175.4° |
| C13 | C14 | C15 | H121 | 152.6° | 76.2° |
| C13 | C14 | C15 | H122 | 86.3° | 160.5° |
| C14 | C13 | C18 | H203 | 68.3° | 171.7° |
| C14 | C13 | C18 | H202 | 51.7° | 51.7° |
| C14 | C13 | C18 | H201 | 171.7° | 68.3° |
| C12 | C13 | C17 | O03 | 35.2° | 26.8° |
| C12 | C13 | C14 | C08 | 59.4° | 70.8° |
| C13 | C12 | C11 | H092 | 120.7° | 119.4° |
| C13 | C12 | C11 | H091 | 120.7° | 119.6° |
| C13 | C12 | C11 | C09 | 52.3° | 57.5° |
| C13 | C12 | C11 | H231 | 167.9° | 178.1° |
| C13 | C12 | H092 | H091 | 117.8° | 121.2° |
| C12 | C13 | C14 | H111 | 56.8° | 49.4° |
| C12 | C13 | C18 | H203 | 50.8° | 53.9° |
| C12 | C13 | C18 | H202 | 170.8° | 66.0° |
| C12 | C13 | C18 | H201 | 69.2° | 173.9° |
| O03 | C17 | C16 | H132 | 141.5° | 125.2° |
| O03 | C17 | C16 | H131 | 19.9° | 3.6° |
| C14 | C08 | C07 | C09 | 119.5° | 117.9° |
| C14 | C08 | C07 | H211 | 120.7° | 120.7° |
| C14 | C08 | C09 | H211 | 119.1° | 119.7° |
| C14 | C08 | C07 | C06 | 179.8° | 178.4° |
| C14 | C08 | C09 | C11 | 46.6° | 57.9° |
| C14 | C08 | C09 | C10 | 179.1° | 177.9° |
| C14 | C08 | C07 | H082 | 59.5° | 58.3° |
| C14 | C08 | C07 | H081 | 59.9° | 61.7° |
| C14 | C08 | C09 | H221 | 67.5° | 63.0° |
| C08 | C14 | C15 | H121 | 71.3° | 38.3° |
| C08 | C14 | C15 | H122 | 49.8° | 85.0° |
| C07 | C08 | C09 | H211 | 120.0° | 120.9° |
| C08 | C07 | C06 | H082 | 120.3° | 120.1° |
| C08 | C07 | C06 | H081 | 120.3° | 120.0° |
| C08 | C07 | C06 | C05 | 49.4° | 55.2° |
| C07 | C08 | C09 | C11 | 167.4° | 177.2° |
| C07 | C08 | C09 | C10 | 60.0° | 62.7° |
| C08 | C07 | C06 | H072 | 170.7° | 64.5° |
| C08 | C07 | C06 | H071 | 71.9° | 174.8° |
| C08 | C07 | H082 | H081 | 119.0° | 119.9° |
| C07 | C08 | C09 | H221 | 53.4° | 56.4° |
| C07 | C08 | C14 | H111 | 59.6° | 63.1° |
| C09 | C08 | C07 | C06 | 60.3° | 63.8° |
| C08 | C09 | C11 | C12 | 47.2° | 54.1° |
| C08 | C09 | C11 | C10 | 131.0° | 120.3° |
| C08 | C09 | C11 | H221 | 114.2° | 120.9° |
| C08 | C09 | C10 | H221 | 113.6° | 119.2° |
| C08 | C09 | C10 | C05 | 47.7° | 54.4° |
| C08 | C09 | C10 | C01 | 176.4° | 178.9° |
| C09 | C08 | C07 | H082 | 60.0° | 176.1° |
| C09 | C08 | C07 | H081 | 179.4° | 56.2° |
| C08 | C09 | C11 | H231 | 162.6° | 174.7° |
| C09 | C08 | C14 | H111 | 60.5° | 56.1° |
| C07 | C06 | C05 | H072 | 121.3° | 119.6° |
| C07 | C06 | C05 | H071 | 121.3° | 119.7° |
| C07 | C06 | C05 | C10 | 35.0° | 51.5° |
| C07 | C06 | C05 | C04 | 123.3° | 128.4° |
| C07 | C06 | H072 | H071 | 115.8° | 120.7° |
| C06 | C07 | H082 | H081 | 119.0° | 119.9° |
| C06 | C07 | C08 | H211 | 59.5° | 57.6° |
| C06 | C05 | C10 | C09 | 33.5° | 51.6° |
| C06 | C05 | C10 | C04 | 160.0° | 179.9° |
| C06 | C05 | C10 | C01 | 163.9° | 176.6° |
| C06 | C05 | C04 | C03 | 155.0° | 179.1° |
| C06 | C05 | C04 | H041 | 25.0° | 1.0° |
| C05 | C06 | H072 | H071 | 115.9° | 120.7° |
| C05 | C06 | C07 | H082 | 70.9° | 175.3° |
| C05 | C06 | C07 | H081 | 169.7° | 64.8° |
| C12 | C11 | C09 | H231 | 115.5° | 120.6° |
| C12 | C11 | C09 | C10 | 178.1° | 174.4° |
| C12 | C11 | C09 | H221 | 67.1° | 66.7° |
| C11 | C12 | H092 | H091 | 117.7° | 121.0° |
| C12 | C11 | O02 | H241 | 180.0° | 60.1° |
| C11 | C09 | C10 | H221 | 114.8° | 118.9° |
| C11 | C09 | C10 | C05 | 179.4° | 176.3° |
| C11 | C09 | C10 | C01 | 51.9° | 57.0° |
| C11 | C09 | C08 | H211 | 72.5° | 61.8° |
| C09 | C11 | C12 | H092 | 173.0° | 62.0° |
| C09 | C11 | C12 | H091 | 68.4° | 177.0° |
| C09 | C11 | O02 | H241 | 56.2° | 177.8° |
| C09 | C10 | C05 | C01 | 130.4° | 125.0° |
| C09 | C10 | C05 | C04 | 126.5° | 128.3° |
| C09 | C10 | C01 | C02 | 129.7° | 127.2° |
| C09 | C10 | C01 | H011 | 50.3° | 52.4° |
| C10 | C09 | C08 | H211 | 60.0° | 58.2° |
| C10 | C09 | C11 | H231 | 66.4° | 65.0° |
| C09 | C10 | C19 | H263 | 180.0° | 80.9° |
| C09 | C10 | C19 | H261 | 60.0° | 159.0° |
| C09 | C10 | C19 | H262 | 60.0° | 39.1° |
| C05 | C10 | C01 | C02 | 1.8° | 2.9° |
| C10 | C05 | C04 | C03 | 1.8° | 0.8° |
| C05 | C10 | C01 | H011 | 178.2° | 176.7° |
| C10 | C05 | C04 | H041 | 178.2° | 179.2° |
| C10 | C05 | C06 | H072 | 156.3° | 68.1° |
| C10 | C05 | C06 | H071 | 86.3° | 171.1° |
| C05 | C10 | C09 | H221 | 65.9° | 64.8° |
| C05 | C10 | C19 | H263 | 57.9° | 161.1° |
| C05 | C10 | C19 | H261 | 62.1° | 41.0° |
| C05 | C10 | C19 | H262 | 177.8° | 79.0° |
| C01 | C10 | C05 | C04 | 4.0° | 3.3° |
| C10 | C01 | C02 | H011 | 180.0° | 179.6° |
| C10 | C01 | C02 | C03 | 6.4° | 0.1° |
| C10 | C01 | C02 | H021 | 173.6° | 179.8° |
| C01 | C10 | C09 | H221 | 62.9° | 61.9° |
| C01 | C10 | C19 | H263 | 57.8° | 38.4° |
| C01 | C10 | C19 | H261 | 177.8° | 81.6° |
| C01 | C10 | C19 | H262 | 62.2° | 158.4° |
| C05 | C04 | C03 | H041 | 180.0° | 180.0° |
| C05 | C04 | C03 | C02 | 9.4° | 2.2° |
| C05 | C04 | C03 | O01 | 169.3° | 177.8° |
| C04 | C05 | C06 | H072 | 2.0° | 112.0° |
| C04 | C05 | C06 | H071 | 115.4° | 8.7° |
| C01 | C02 | C03 | C04 | 11.4° | 2.6° |
| C01 | C02 | C03 | H021 | 180.0° | 179.9° |
| C01 | C02 | C03 | O01 | 167.3° | 177.4° |
| C04 | C03 | C02 | O01 | 178.7° | 180.0° |
| C04 | C03 | C02 | H021 | 168.6° | 177.5° |
| C03 | C02 | C01 | H011 | 173.6° | 179.5° |
| C02 | C03 | C04 | H041 | 170.6° | 177.8° |
| O01 | C03 | C02 | H021 | 12.6° | 2.5° |
| O01 | C03 | C04 | H041 | 10.7° | 2.2° |
| H011 | C01 | C02 | H021 | 6.4° | 0.6° |
| H072 | C06 | C07 | H082 | 50.4° | 55.6° |
| H072 | C06 | C07 | H081 | 69.0° | 175.6° |
| H071 | C06 | C07 | H082 | 167.8° | 65.1° |
| H071 | C06 | C07 | H081 | 48.4° | 54.9° |
| H082 | C07 | C08 | H211 | 179.8° | 62.5° |
| H081 | C07 | C08 | H211 | 60.8° | 177.6° |
| H211 | C08 | C09 | H221 | 173.4° | 177.3° |
| H211 | C08 | C14 | H111 | 179.6° | 176.2° |
| H221 | C09 | C11 | H231 | 48.4° | 53.8° |
| H231 | C11 | C12 | H092 | 71.4° | 58.6° |
| H231 | C11 | C12 | H091 | 47.1° | 62.4° |
| H231 | C11 | O02 | H241 | 63.4° | 58.9° |
| H111 | C14 | C15 | H121 | 43.1° | 165.0° |
| H111 | C14 | C15 | H122 | 164.2° | 41.8° |
| H121 | C15 | C16 | H132 | 114.8° | 23.0° |
| H121 | C15 | C16 | H131 | 6.9° | 144.5° |
| H122 | C15 | C16 | H132 | 6.4° | 100.3° |
| H122 | C15 | C16 | H131 | 128.0° | 21.2° |
| H203 | C18 | H202 | H201 | 120.0° | 120.0° |
| H263 | C19 | H261 | H262 | 120.0° | 120.0° |
| H152 | C21 | O05 | H171 | 129.1° | 60.0° |
| H151 | C21 | O05 | H171 | 111.9° | 60.0° |
