A1CAF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C01 | sing | 1.53Å | 1.55Å | |
| C04 | C03 | sing | 1.53Å | 1.52Å | |
| C05 | C04 | sing | 1.53Å | 1.50Å | |
| C03 | C02 | sing | 1.53Å | 1.52Å | |
| N06 | C02 | sing | 1.47Å | 1.47Å | |
| C07 | N06 | sing | 1.35Å | 1.38Å | |
| C09 | O08 | sing | 1.45Å | 1.42Å | |
| C10 | C09 | sing | 1.54Å | 1.55Å | |
| C11 | C10 | sing | 1.54Å | 1.50Å | |
| C12 | C11 | sing | 1.55Å | 1.53Å | |
| C13 | C12 | sing | 1.55Å | 1.55Å | |
| C14 | C12 | sing | 1.51Å | 1.47Å | |
| C15 | C14 | doub | 1.35Å | 1.39Å | Aromatic |
| C16 | C15 | sing | 1.40Å | 1.45Å | Aromatic |
| C18 | N17 | sing | 1.35Å | 1.43Å | |
| C20 | C19 | sing | 1.53Å | 1.56Å | |
| C21 | C20 | sing | 1.53Å | 1.55Å | |
| C22 | C21 | sing | 1.53Å | 1.53Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C19 | C18 | sing | 1.51Å | 1.59Å | |
| O25 | C18 | doub | 1.21Å | 1.20Å | |
| N17 | C16 | sing | 1.40Å | 1.44Å | |
| N26 | C16 | doub | 1.31Å | 1.38Å | Aromatic |
| N27 | N26 | sing | 1.40Å | 1.34Å | Aromatic |
| O08 | C07 | sing | 1.35Å | 1.39Å | |
| O28 | C07 | doub | 1.22Å | 1.22Å | |
| C03 | C05 | sing | 1.53Å | 1.53Å | |
| C09 | C13 | sing | 1.54Å | 1.49Å | |
| C14 | N27 | sing | 1.35Å | 1.37Å | Aromatic |
| C19 | C24 | sing | 1.53Å | 1.54Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | 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 | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| N06 | H061 | sing | 0.97Å | 1.00Å | |
| N17 | H171 | 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) |
| C01 | C02 | C03 | 109.6° | 109.4° |
| C01 | C02 | N06 | 110.8° | 109.4° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.4° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C01 | C02 | H021 | 107.3° | 109.5° |
| C03 | C04 | C05 | 60.7° | 60.0° |
| C04 | C03 | C02 | 118.7° | 117.5° |
| C04 | C03 | C05 | 59.1° | 60.0° |
| C04 | C03 | H031 | 116.5° | 117.5° |
| C03 | C04 | H041 | 119.9° | 117.5° |
| C03 | C04 | H042 | 119.8° | 117.5° |
| C04 | C05 | C03 | 60.2° | 60.0° |
| C05 | C04 | H041 | 119.9° | 117.5° |
| C05 | C04 | H042 | 119.9° | 117.5° |
| C04 | C05 | H051 | 120.0° | 117.5° |
| C04 | C05 | H052 | 120.0° | 117.5° |
| C03 | C02 | N06 | 113.1° | 109.5° |
| C02 | C03 | C05 | 117.5° | 117.5° |
| C03 | C02 | H021 | 107.6° | 109.5° |
| C02 | C03 | H031 | 116.4° | 115.6° |
| C02 | N06 | C07 | 118.9° | 120.0° |
| N06 | C02 | H021 | 108.3° | 109.5° |
| C02 | N06 | H061 | 120.5° | 120.0° |
| N06 | C07 | O08 | 115.0° | 120.0° |
| N06 | C07 | O28 | 125.8° | 120.0° |
| C07 | N06 | H061 | 120.6° | 120.0° |
| O08 | C09 | C10 | 108.6° | 110.1° |
| C09 | O08 | C07 | 117.6° | 117.0° |
| O08 | C09 | C13 | 112.4° | 110.0° |
| O08 | C09 | H091 | 112.4° | 110.0° |
| C09 | C10 | C11 | 103.7° | 106.6° |
| C10 | C09 | C13 | 101.3° | 106.6° |
| C10 | C09 | H091 | 110.4° | 110.1° |
| C09 | C10 | H102 | 110.9° | 110.0° |
| C09 | C10 | H101 | 110.9° | 110.0° |
| C10 | C11 | C12 | 101.4° | 104.2° |
| C10 | C11 | H112 | 111.5° | 110.5° |
| C10 | C11 | H111 | 111.5° | 110.4° |
| C11 | C10 | H102 | 110.9° | 110.0° |
| C11 | C10 | H101 | 110.9° | 110.0° |
| C11 | C12 | C13 | 104.6° | 102.8° |
| C11 | C12 | C14 | 115.9° | 110.7° |
| C12 | C11 | H112 | 111.4° | 110.5° |
| C12 | C11 | H111 | 111.5° | 110.6° |
| C11 | C12 | H121 | 108.4° | 110.8° |
| C13 | C12 | C14 | 110.0° | 110.9° |
| C12 | C13 | C09 | 107.8° | 104.2° |
| C13 | C12 | H121 | 108.3° | 110.8° |
| C12 | C13 | H132 | 109.9° | 110.5° |
| C12 | C13 | H131 | 109.9° | 110.5° |
| C12 | C14 | C15 | 133.0° | 126.1° |
| C12 | C14 | N27 | 121.0° | 126.1° |
| C14 | C12 | H121 | 109.3° | 110.7° |
| C14 | C15 | C16 | 105.9° | 107.9° |
| C15 | C14 | N27 | 106.0° | 107.8° |
| C14 | C15 | H151 | 127.0° | 126.1° |
| C15 | C16 | N17 | 128.5° | 126.0° |
| C15 | C16 | N26 | 108.4° | 108.0° |
| C16 | C15 | H151 | 127.1° | 126.0° |
| N17 | C18 | C19 | 121.6° | 119.9° |
| N17 | C18 | O25 | 120.0° | 120.0° |
| C18 | N17 | C16 | 128.8° | 120.0° |
| C18 | N17 | H171 | 115.6° | 120.1° |
| C19 | C20 | C21 | 112.3° | 109.5° |
| C20 | C19 | C18 | 112.5° | 109.5° |
| C20 | C19 | C24 | 107.9° | 109.5° |
| C20 | C19 | H191 | 108.5° | 109.5° |
| C19 | C20 | H202 | 108.8° | 109.5° |
| C19 | C20 | H201 | 108.8° | 109.5° |
| C20 | C21 | C22 | 112.4° | 109.5° |
| C21 | C20 | H202 | 108.8° | 109.5° |
| C21 | C20 | H201 | 108.8° | 109.5° |
| C20 | C21 | H212 | 108.7° | 109.5° |
| C20 | C21 | H211 | 108.7° | 109.5° |
| C21 | C22 | C23 | 111.3° | 109.5° |
| C22 | C21 | H212 | 108.7° | 109.5° |
| C22 | C21 | H211 | 108.7° | 109.5° |
| C21 | C22 | H222 | 109.0° | 109.5° |
| C21 | C22 | H221 | 109.0° | 109.4° |
| C22 | C23 | C24 | 113.1° | 109.5° |
| C23 | C22 | H222 | 109.0° | 109.5° |
| C23 | C22 | H221 | 109.0° | 109.5° |
| C22 | C23 | H232 | 108.5° | 109.5° |
| C22 | C23 | H231 | 108.6° | 109.5° |
| C23 | C24 | C19 | 113.1° | 109.5° |
| C24 | C23 | H232 | 108.6° | 109.5° |
| C24 | C23 | H231 | 108.6° | 109.5° |
| C23 | C24 | H242 | 108.6° | 109.5° |
| C23 | C24 | H241 | 108.6° | 109.5° |
| C19 | C18 | O25 | 118.4° | 120.0° |
| C18 | C19 | C24 | 111.0° | 109.4° |
| C18 | C19 | H191 | 108.1° | 109.5° |
| N17 | C16 | N26 | 123.0° | 126.0° |
| C16 | N17 | H171 | 115.6° | 120.0° |
| C16 | N26 | N27 | 106.3° | 108.2° |
| N26 | N27 | C14 | 113.4° | 108.1° |
| N26 | N27 | H271 | 123.3° | 125.9° |
| O08 | C07 | O28 | 119.2° | 120.0° |
| C05 | C03 | H031 | 116.4° | 117.5° |
| C03 | C05 | H051 | 120.0° | 117.6° |
| C03 | C05 | H052 | 120.0° | 117.5° |
| C09 | C13 | H132 | 109.9° | 110.5° |
| C09 | C13 | H131 | 109.9° | 110.6° |
| C13 | C09 | H091 | 111.2° | 110.0° |
| C14 | N27 | H271 | 123.3° | 126.0° |
| C24 | C19 | H191 | 108.8° | 109.5° |
| C19 | C24 | H242 | 108.5° | 109.5° |
| C19 | C24 | H241 | 108.5° | 109.5° |
| H112 | C11 | H111 | 109.4° | 110.4° |
| H132 | C13 | H131 | 109.5° | 110.4° |
| H202 | C20 | H201 | 109.5° | 109.5° |
| H212 | C21 | H211 | 109.5° | 109.5° |
| H222 | C22 | H221 | 109.5° | 109.5° |
| H232 | C23 | H231 | 109.5° | 109.5° |
| H242 | C24 | H241 | 109.5° | 109.5° |
| H013 | C01 | H012 | 109.5° | 109.5° |
| H013 | C01 | H011 | 109.5° | 109.5° |
| H012 | C01 | H011 | 109.5° | 109.4° |
| H041 | C04 | H042 | 109.5° | 115.5° |
| H051 | C05 | H052 | 109.5° | 115.5° |
| H102 | C10 | H101 | 109.5° | 110.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | C03 | C04 | 149.0° | 128.6° |
| C01 | C02 | C03 | N06 | 124.1° | 120.0° |
| C01 | C02 | C03 | H021 | 116.4° | 120.0° |
| C01 | C02 | N06 | H021 | 117.4° | 120.0° |
| C01 | C02 | N06 | C07 | 155.4° | 85.0° |
| C01 | C02 | C03 | C05 | 81.0° | 60.0° |
| C02 | C01 | H013 | H012 | 120.0° | 120.1° |
| C02 | C01 | H013 | H011 | 120.0° | 120.1° |
| C02 | C01 | H012 | H011 | 120.0° | 120.0° |
| C01 | C02 | C03 | H031 | 63.8° | 85.7° |
| C01 | C02 | N06 | H061 | 24.6° | 95.0° |
| C03 | C04 | C05 | H041 | 109.6° | 107.5° |
| C03 | C04 | C05 | H042 | 109.6° | 107.5° |
| C04 | C03 | C02 | C05 | 68.0° | 68.6° |
| C04 | C03 | C02 | H031 | 147.2° | 145.7° |
| C04 | C03 | C02 | N06 | 86.9° | 111.4° |
| C04 | C03 | C05 | H031 | 106.5° | 107.5° |
| C04 | C03 | C02 | H021 | 32.6° | 8.6° |
| C03 | C04 | H041 | H042 | 144.3° | 145.7° |
| C03 | C04 | C05 | H051 | 109.5° | 107.6° |
| C03 | C04 | C05 | H052 | 109.5° | 107.5° |
| C05 | C04 | H041 | H042 | 144.4° | 145.7° |
| C04 | C05 | H051 | H052 | 144.6° | 145.6° |
| C03 | C02 | N06 | H021 | 119.1° | 120.1° |
| C03 | C02 | N06 | C07 | 81.1° | 155.0° |
| C02 | C03 | C05 | H031 | 144.8° | 145.0° |
| C03 | C02 | C01 | H013 | 180.0° | 60.0° |
| C03 | C02 | C01 | H012 | 60.0° | 60.0° |
| C03 | C02 | C01 | H011 | 60.0° | 180.0° |
| C02 | C03 | C04 | H041 | 3.1° | 0.0° |
| C02 | C03 | C04 | H042 | 143.7° | 145.0° |
| C02 | C03 | C05 | H051 | 0.8° | 145.1° |
| C02 | C03 | C05 | H052 | 141.8° | 0.0° |
| C03 | C02 | N06 | H061 | 98.9° | 24.9° |
| C02 | N06 | C07 | H061 | 180.0° | 179.9° |
| C02 | N06 | C07 | O08 | 14.6° | 180.0° |
| C02 | N06 | C07 | O28 | 165.0° | 0.1° |
| N06 | C02 | C03 | C05 | 154.9° | 180.0° |
| N06 | C02 | C01 | H013 | 54.6° | 180.0° |
| N06 | C02 | C01 | H012 | 174.6° | 60.0° |
| N06 | C02 | C01 | H011 | 65.4° | 60.0° |
| N06 | C02 | C03 | H031 | 60.3° | 34.3° |
| N06 | C07 | O08 | C09 | 158.0° | 180.0° |
| N06 | C07 | O08 | O28 | 179.6° | 180.0° |
| C07 | N06 | C02 | H021 | 38.0° | 34.9° |
| O08 | C09 | C10 | C13 | 118.4° | 119.3° |
| O08 | C09 | C10 | H091 | 123.7° | 121.4° |
| O08 | C09 | C10 | C11 | 75.5° | 119.3° |
| O08 | C09 | C13 | C12 | 92.2° | 142.9° |
| C09 | O08 | C07 | O28 | 22.4° | 0.0° |
| O08 | C09 | C13 | H091 | 127.1° | 121.4° |
| O08 | C09 | C13 | H132 | 27.6° | 24.2° |
| O08 | C09 | C13 | H131 | 148.1° | 98.3° |
| O08 | C09 | C10 | H102 | 43.6° | 121.4° |
| O08 | C09 | C10 | H101 | 165.5° | 0.0° |
| C09 | C10 | C11 | H102 | 119.1° | 119.3° |
| C09 | C10 | C11 | H101 | 119.1° | 119.3° |
| C09 | C10 | C11 | C12 | 45.1° | 23.6° |
| C10 | C09 | C13 | C12 | 23.5° | 23.6° |
| C10 | C09 | O08 | C07 | 71.7° | 92.8° |
| C10 | C09 | C13 | H091 | 117.3° | 119.3° |
| C09 | C10 | C11 | H112 | 73.6° | 142.3° |
| C09 | C10 | C11 | H111 | 163.8° | 95.2° |
| C10 | C09 | C13 | H132 | 143.3° | 95.1° |
| C10 | C09 | C13 | H131 | 96.2° | 142.4° |
| C09 | C10 | H102 | H101 | 122.7° | 121.4° |
| C10 | C11 | C12 | H112 | 118.7° | 118.7° |
| C10 | C11 | C12 | H111 | 118.7° | 118.7° |
| C10 | C11 | C12 | C13 | 29.6° | 37.9° |
| C10 | C11 | C12 | C14 | 150.9° | 156.4° |
| C11 | C10 | C09 | C13 | 43.0° | 0.0° |
| C10 | C11 | H112 | H111 | 123.7° | 122.5° |
| C10 | C11 | C12 | H121 | 85.8° | 80.4° |
| C11 | C10 | C09 | H091 | 160.9° | 119.3° |
| C11 | C10 | H102 | H101 | 122.6° | 121.4° |
| C11 | C12 | C13 | C14 | 125.1° | 118.4° |
| C11 | C12 | C13 | H121 | 115.5° | 118.3° |
| C11 | C12 | C14 | H121 | 122.8° | 123.2° |
| C11 | C12 | C14 | C15 | 39.5° | 96.7° |
| C11 | C12 | C13 | C09 | 3.3° | 38.0° |
| C11 | C12 | C14 | N27 | 141.0° | 83.6° |
| C12 | C11 | H112 | H111 | 123.7° | 122.7° |
| C11 | C12 | C13 | H132 | 116.5° | 80.7° |
| C11 | C12 | C13 | H131 | 123.0° | 156.8° |
| C12 | C11 | C10 | H102 | 164.2° | 95.7° |
| C12 | C11 | C10 | H101 | 74.0° | 142.9° |
| C13 | C12 | C14 | H121 | 118.7° | 123.3° |
| C13 | C12 | C14 | C15 | 78.9° | 149.9° |
| C12 | C13 | C09 | H132 | 119.8° | 118.7° |
| C12 | C13 | C09 | H131 | 119.7° | 118.7° |
| C13 | C12 | C14 | N27 | 100.6° | 29.8° |
| C13 | C12 | C11 | H112 | 89.1° | 156.6° |
| C13 | C12 | C11 | H111 | 148.3° | 80.7° |
| C12 | C13 | H132 | H131 | 120.7° | 122.5° |
| C12 | C13 | C09 | H091 | 140.8° | 95.7° |
| C12 | C14 | C15 | N27 | 179.6° | 179.7° |
| C12 | C14 | C15 | C16 | 179.5° | 180.0° |
| C12 | C14 | N27 | N26 | 179.8° | 179.9° |
| C14 | C12 | C13 | C09 | 128.4° | 156.3° |
| C14 | C12 | C11 | H112 | 32.2° | 84.9° |
| C14 | C12 | C11 | H111 | 90.4° | 37.7° |
| C14 | C12 | C13 | H132 | 8.7° | 37.6° |
| C14 | C12 | C13 | H131 | 111.8° | 84.8° |
| C12 | C14 | C15 | H151 | 0.5° | 0.1° |
| C12 | C14 | N27 | H271 | 0.2° | 0.0° |
| C14 | C15 | C16 | H151 | 180.0° | 179.9° |
| C14 | C15 | C16 | N17 | 179.1° | 179.9° |
| C14 | C15 | C16 | N26 | 0.3° | 0.0° |
| C15 | C14 | N27 | N26 | 0.2° | 0.4° |
| C15 | C14 | C12 | H121 | 162.4° | 26.5° |
| C15 | C14 | N27 | H271 | 179.8° | 179.7° |
| C15 | C16 | N17 | C18 | 4.7° | 0.0° |
| C15 | C16 | N17 | N26 | 179.3° | 179.9° |
| C15 | C16 | N26 | N27 | 0.4° | 0.2° |
| C16 | C15 | C14 | N27 | 0.1° | 0.2° |
| C15 | C16 | N17 | H171 | 175.3° | 180.0° |
| N17 | C18 | C19 | C20 | 113.1° | 60.0° |
| N17 | C18 | C19 | O25 | 179.8° | 180.0° |
| C18 | N17 | C16 | H171 | 180.0° | 180.0° |
| C18 | N17 | C16 | N26 | 174.6° | 180.0° |
| N17 | C18 | C19 | C24 | 125.9° | 180.0° |
| N17 | C18 | C19 | H191 | 6.7° | 60.0° |
| C19 | C20 | C21 | H202 | 120.4° | 120.0° |
| C19 | C20 | C21 | H201 | 120.4° | 120.0° |
| C19 | C20 | C21 | C22 | 55.5° | 60.0° |
| C20 | C19 | C24 | C23 | 55.9° | 60.0° |
| C20 | C19 | C18 | C24 | 121.0° | 120.0° |
| C20 | C19 | C18 | H191 | 119.8° | 120.0° |
| C20 | C19 | C18 | O25 | 66.7° | 120.0° |
| C20 | C19 | C24 | H191 | 117.5° | 120.0° |
| C19 | C20 | H202 | H201 | 118.7° | 120.0° |
| C19 | C20 | C21 | H212 | 175.9° | 180.0° |
| C19 | C20 | C21 | H211 | 64.9° | 60.0° |
| C20 | C19 | C24 | H242 | 64.6° | 180.0° |
| C20 | C19 | C24 | H241 | 176.4° | 60.0° |
| C20 | C21 | C22 | H212 | 120.5° | 120.0° |
| C20 | C21 | C22 | H211 | 120.4° | 120.0° |
| C20 | C21 | C22 | C23 | 51.1° | 60.0° |
| C21 | C20 | C19 | C18 | 178.9° | 180.0° |
| C21 | C20 | C19 | C24 | 56.2° | 60.0° |
| C21 | C20 | C19 | H191 | 61.5° | 60.0° |
| C21 | C20 | H202 | H201 | 118.7° | 120.0° |
| C20 | C21 | H212 | H211 | 118.7° | 120.0° |
| C20 | C21 | C22 | H222 | 69.2° | 60.0° |
| C20 | C21 | C22 | H221 | 171.4° | 180.0° |
| C21 | C22 | C23 | H222 | 120.3° | 120.0° |
| C21 | C22 | C23 | H221 | 120.3° | 120.0° |
| C21 | C22 | C23 | C24 | 50.7° | 60.0° |
| C22 | C21 | C20 | H202 | 64.9° | 60.0° |
| C22 | C21 | C20 | H201 | 175.9° | 180.0° |
| C22 | C21 | H212 | H211 | 118.6° | 120.0° |
| C21 | C22 | H222 | H221 | 119.2° | 120.0° |
| C21 | C22 | C23 | H232 | 171.2° | 180.0° |
| C21 | C22 | C23 | H231 | 69.9° | 60.0° |
| C22 | C23 | C24 | H232 | 120.5° | 120.0° |
| C22 | C23 | C24 | H231 | 120.5° | 120.0° |
| C22 | C23 | C24 | C19 | 54.8° | 60.0° |
| C23 | C22 | C21 | H212 | 171.6° | 180.0° |
| C23 | C22 | C21 | H211 | 69.3° | 60.0° |
| C23 | C22 | H222 | H221 | 119.1° | 120.0° |
| C22 | C23 | H232 | H231 | 118.3° | 120.0° |
| C22 | C23 | C24 | H242 | 65.7° | 180.0° |
| C22 | C23 | C24 | H241 | 175.4° | 60.0° |
| C23 | C24 | C19 | C18 | 179.6° | 180.0° |
| C23 | C24 | C19 | H242 | 120.5° | 120.0° |
| C23 | C24 | C19 | H241 | 120.5° | 120.0° |
| C23 | C24 | C19 | H191 | 61.6° | 60.0° |
| C24 | C23 | C22 | H222 | 69.6° | 60.0° |
| C24 | C23 | C22 | H221 | 171.0° | 180.0° |
| C24 | C23 | H232 | H231 | 118.4° | 120.0° |
| C23 | C24 | H242 | H241 | 118.4° | 120.0° |
| C19 | C18 | N17 | C16 | 178.5° | 180.0° |
| C18 | C19 | C24 | H191 | 118.8° | 120.0° |
| C18 | C19 | C20 | H202 | 58.5° | 60.0° |
| C18 | C19 | C20 | H201 | 60.6° | 60.1° |
| C18 | C19 | C24 | H242 | 59.0° | 60.0° |
| C18 | C19 | C24 | H241 | 59.9° | 60.0° |
| C19 | C18 | N17 | H171 | 1.5° | 0.0° |
| O25 | C18 | N17 | C16 | 1.7° | 0.0° |
| O25 | C18 | C19 | C24 | 54.3° | 0.0° |
| O25 | C18 | C19 | H191 | 173.6° | 120.0° |
| O25 | C18 | N17 | H171 | 178.3° | 180.0° |
| N17 | C16 | N26 | N27 | 179.0° | 179.7° |
| N17 | C16 | C15 | H151 | 0.9° | 0.1° |
| C16 | N26 | N27 | C14 | 0.4° | 0.4° |
| N26 | C16 | C15 | H151 | 179.8° | 179.9° |
| N26 | C16 | N17 | H171 | 5.4° | 0.1° |
| C16 | N26 | N27 | H271 | 179.6° | 179.8° |
| N26 | N27 | C14 | H271 | 180.0° | 179.9° |
| C07 | O08 | C09 | C13 | 177.2° | 150.0° |
| C07 | O08 | C09 | H091 | 50.8° | 28.7° |
| O08 | C07 | N06 | H061 | 165.4° | 0.1° |
| O28 | C07 | N06 | H061 | 15.0° | 180.0° |
| C05 | C03 | C02 | H021 | 35.4° | 60.0° |
| C03 | C05 | H051 | H052 | 144.7° | 145.8° |
| C09 | C13 | C12 | H121 | 112.2° | 80.4° |
| C09 | C13 | H132 | H131 | 120.8° | 122.7° |
| C13 | C09 | C10 | H102 | 162.0° | 119.3° |
| C13 | C09 | C10 | H101 | 76.1° | 119.3° |
| N27 | C14 | C12 | H121 | 18.1° | 153.2° |
| N27 | C14 | C15 | H151 | 180.0° | 179.8° |
| C24 | C19 | C20 | H202 | 64.3° | 60.0° |
| C24 | C19 | C20 | H201 | 176.6° | 180.0° |
| C19 | C24 | C23 | H232 | 175.4° | 180.0° |
| C19 | C24 | C23 | H231 | 65.7° | 60.0° |
| C19 | C24 | H242 | H241 | 118.3° | 120.0° |
| H112 | C11 | C12 | H121 | 155.5° | 38.3° |
| H112 | C11 | C10 | H102 | 45.5° | 23.0° |
| H112 | C11 | C10 | H101 | 167.3° | 98.4° |
| H111 | C11 | C12 | H121 | 32.9° | 160.9° |
| H111 | C11 | C10 | H102 | 77.1° | 145.5° |
| H111 | C11 | C10 | H101 | 44.7° | 24.1° |
| H121 | C12 | C13 | H132 | 128.1° | 160.9° |
| H121 | C12 | C13 | H131 | 7.6° | 38.4° |
| H132 | C13 | C09 | H091 | 99.5° | 145.6° |
| H131 | C13 | C09 | H091 | 21.1° | 23.0° |
| H191 | C19 | C20 | H202 | 178.1° | 180.0° |
| H191 | C19 | C20 | H201 | 58.9° | 60.0° |
| H191 | C19 | C24 | H242 | 177.9° | 60.0° |
| H191 | C19 | C24 | H241 | 59.0° | 180.0° |
| H202 | C20 | C21 | H212 | 55.5° | 60.0° |
| H202 | C20 | C21 | H211 | 174.6° | 180.0° |
| H201 | C20 | C21 | H212 | 63.6° | 60.0° |
| H201 | C20 | C21 | H211 | 55.5° | 60.0° |
| H212 | C21 | C22 | H222 | 51.3° | 60.0° |
| H212 | C21 | C22 | H221 | 68.2° | 60.0° |
| H211 | C21 | C22 | H222 | 170.4° | 180.0° |
| H211 | C21 | C22 | H221 | 50.9° | 60.1° |
| H222 | C22 | C23 | H232 | 50.9° | 60.0° |
| H222 | C22 | C23 | H231 | 169.8° | 180.0° |
| H221 | C22 | C23 | H232 | 68.5° | 60.0° |
| H221 | C22 | C23 | H231 | 50.4° | 60.0° |
| H232 | C23 | C24 | H242 | 54.8° | 60.0° |
| H232 | C23 | C24 | H241 | 64.1° | 60.0° |
| H231 | C23 | C24 | H242 | 173.8° | 60.0° |
| H231 | C23 | C24 | H241 | 54.8° | 180.0° |
| H013 | C01 | H012 | H011 | 120.0° | 119.9° |
| H013 | C01 | C02 | H021 | 63.4° | 60.0° |
| H012 | C01 | C02 | H021 | 56.6° | 179.9° |
| H011 | C01 | C02 | H021 | 176.6° | 60.0° |
| H021 | C02 | C03 | H031 | 179.8° | 154.3° |
| H021 | C02 | N06 | H061 | 142.0° | 145.0° |
| H031 | C03 | C04 | H041 | 144.1° | 145.0° |
| H031 | C03 | C04 | H042 | 3.4° | 0.0° |
| H031 | C03 | C05 | H051 | 144.0° | 0.1° |
| H031 | C03 | C05 | H052 | 3.0° | 145.0° |
| H041 | C04 | C05 | H051 | 0.1° | 144.9° |
| H041 | C04 | C05 | H052 | 140.9° | 0.0° |
| H042 | C04 | C05 | H051 | 140.9° | 0.1° |
| H042 | C04 | C05 | H052 | 0.1° | 145.0° |
| H091 | C09 | C10 | H102 | 80.1° | 0.0° |
| H091 | C09 | C10 | H101 | 41.8° | 121.4° |
