A1BWH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C11 | doub | 1.36Å | 1.40Å | Aromatic |
| C10 | C09 | sing | 1.47Å | 1.55Å | |
| C10 | N19 | sing | 1.38Å | 1.35Å | Aromatic |
| C11 | C12 | sing | 1.42Å | 1.43Å | Aromatic |
| C12 | C13 | doub | 1.40Å | 1.43Å | Aromatic |
| C12 | C18 | sing | 1.41Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.36Å | 1.41Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C18 | doub | 1.39Å | 1.42Å | Aromatic |
| C16 | F17 | sing | 1.35Å | 1.37Å | |
| C18 | N19 | sing | 1.38Å | 1.38Å | Aromatic |
| C02 | C03 | sing | 1.51Å | 1.53Å | |
| C02 | N21 | sing | 1.35Å | 1.47Å | |
| C02 | O01 | doub | 1.21Å | 1.19Å | |
| C03 | C04 | sing | 1.53Å | 1.53Å | |
| C03 | N08 | sing | 1.46Å | 1.47Å | |
| C04 | C05 | sing | 1.53Å | 1.55Å | |
| C05 | C06 | sing | 1.53Å | 1.52Å | |
| C05 | C07 | sing | 1.53Å | 1.52Å | |
| C06 | C07 | sing | 1.53Å | 1.53Å | |
| C09 | N08 | sing | 1.35Å | 1.47Å | |
| C09 | O20 | doub | 1.22Å | 1.19Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C22 | C31 | sing | 1.53Å | 1.54Å | |
| C22 | N21 | sing | 1.46Å | 1.47Å | |
| C23 | C24 | sing | 1.53Å | 1.66Å | |
| C24 | C25 | sing | 1.53Å | 1.48Å | |
| C24 | C29 | sing | 1.50Å | 1.57Å | |
| C25 | C26 | sing | 1.53Å | 1.47Å | |
| C26 | C27 | sing | 1.53Å | 1.44Å | |
| C27 | N28 | sing | 1.46Å | 1.53Å | |
| C29 | N28 | sing | 1.33Å | 1.53Å | |
| C29 | O30 | doub | 1.21Å | 1.19Å | |
| C31 | C32 | sing | 1.53Å | 1.56Å | |
| C31 | O34 | sing | 1.43Å | 1.41Å | |
| C32 | O33 | sing | 1.43Å | 1.41Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H062 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| N08 | H081 | sing | 0.97Å | 1.00Å | |
| N19 | H191 | sing | 0.97Å | 1.00Å | |
| N21 | H211 | sing | 0.97Å | 1.00Å | |
| N28 | H281 | sing | 0.97Å | 1.00Å | |
| O33 | H331 | sing | 0.97Å | 0.95Å | |
| O34 | H341 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C11 | C10 | C09 | 127.6° | 125.4° |
| C11 | C10 | N19 | 108.2° | 109.1° |
| C10 | C11 | C12 | 107.7° | 107.7° |
| C10 | C11 | H111 | 126.2° | 126.1° |
| C09 | C10 | N19 | 124.2° | 125.4° |
| C10 | C09 | N08 | 121.7° | 120.0° |
| C10 | C09 | O20 | 119.1° | 120.0° |
| C10 | N19 | C18 | 109.1° | 108.8° |
| C10 | N19 | H191 | 125.4° | 125.6° |
| C11 | C12 | C13 | 134.9° | 133.3° |
| C11 | C12 | C18 | 105.6° | 106.9° |
| C12 | C11 | H111 | 126.2° | 126.2° |
| C13 | C12 | C18 | 119.5° | 119.7° |
| C12 | C13 | C14 | 120.2° | 119.9° |
| C12 | C13 | H131 | 119.9° | 120.1° |
| C12 | C18 | C16 | 120.5° | 119.4° |
| C12 | C18 | N19 | 109.4° | 107.4° |
| C13 | C14 | C15 | 119.8° | 120.6° |
| C14 | C13 | H131 | 119.9° | 120.0° |
| C13 | C14 | H141 | 120.1° | 119.7° |
| C14 | C15 | C16 | 119.9° | 120.7° |
| C15 | C14 | H141 | 120.1° | 119.8° |
| C14 | C15 | H151 | 120.0° | 119.6° |
| C15 | C16 | C18 | 120.1° | 119.7° |
| C15 | C16 | F17 | 120.4° | 120.1° |
| C16 | C15 | H151 | 120.0° | 119.7° |
| C18 | C16 | F17 | 119.6° | 120.2° |
| C16 | C18 | N19 | 130.1° | 133.2° |
| C18 | N19 | H191 | 125.5° | 125.6° |
| C03 | C02 | N21 | 119.4° | 120.0° |
| C03 | C02 | O01 | 120.7° | 120.0° |
| C02 | C03 | C04 | 111.0° | 109.5° |
| C02 | C03 | N08 | 108.5° | 109.5° |
| C02 | C03 | H031 | 108.7° | 109.5° |
| N21 | C02 | O01 | 119.9° | 120.0° |
| C02 | N21 | C22 | 120.3° | 119.9° |
| C02 | N21 | H211 | 119.9° | 120.0° |
| C04 | C03 | N08 | 110.5° | 109.5° |
| C03 | C04 | C05 | 111.3° | 109.4° |
| C04 | C03 | H031 | 108.7° | 109.4° |
| C03 | C04 | H042 | 109.0° | 109.4° |
| C03 | C04 | H041 | 109.0° | 109.5° |
| C03 | N08 | C09 | 117.8° | 120.0° |
| N08 | C03 | H031 | 109.4° | 109.5° |
| C03 | N08 | H081 | 121.1° | 120.0° |
| C04 | C05 | C06 | 115.0° | 117.5° |
| C04 | C05 | C07 | 115.9° | 117.5° |
| C05 | C04 | H042 | 109.0° | 109.5° |
| C05 | C04 | H041 | 109.0° | 109.5° |
| C04 | C05 | H051 | 117.3° | 115.6° |
| C06 | C05 | C07 | 60.5° | 60.0° |
| C05 | C06 | C07 | 59.6° | 60.0° |
| C06 | C05 | H051 | 117.9° | 117.5° |
| C05 | C06 | H062 | 120.1° | 117.5° |
| C05 | C06 | H061 | 120.1° | 117.5° |
| C05 | C07 | C06 | 59.9° | 60.0° |
| C07 | C05 | H051 | 118.0° | 117.5° |
| C05 | C07 | H071 | 120.0° | 117.5° |
| C05 | C07 | H072 | 120.0° | 117.5° |
| C07 | C06 | H062 | 120.1° | 117.5° |
| C07 | C06 | H061 | 120.1° | 117.6° |
| C06 | C07 | H071 | 120.0° | 117.4° |
| C06 | C07 | H072 | 120.0° | 117.5° |
| N08 | C09 | O20 | 119.2° | 120.0° |
| C09 | N08 | H081 | 121.1° | 120.0° |
| C23 | C22 | C31 | 113.4° | 109.5° |
| C23 | C22 | N21 | 107.8° | 109.4° |
| C22 | C23 | C24 | 112.3° | 109.5° |
| C23 | C22 | H221 | 109.0° | 109.5° |
| C22 | C23 | H231 | 108.8° | 109.4° |
| C22 | C23 | H232 | 108.7° | 109.4° |
| C31 | C22 | N21 | 107.9° | 109.5° |
| C22 | C31 | C32 | 109.1° | 109.5° |
| C22 | C31 | O34 | 108.8° | 109.5° |
| C31 | C22 | H221 | 108.8° | 109.5° |
| C22 | C31 | H311 | 109.1° | 109.5° |
| N21 | C22 | H221 | 109.7° | 109.5° |
| C22 | N21 | H211 | 119.8° | 120.1° |
| C23 | C24 | C25 | 101.8° | 109.4° |
| C23 | C24 | C29 | 103.1° | 109.4° |
| C24 | C23 | H231 | 108.8° | 109.5° |
| C24 | C23 | H232 | 108.8° | 109.5° |
| C23 | C24 | H241 | 111.1° | 109.4° |
| C25 | C24 | C29 | 113.6° | 109.9° |
| C24 | C25 | C26 | 117.8° | 108.4° |
| C25 | C24 | H241 | 113.8° | 109.4° |
| C24 | C25 | H252 | 107.4° | 109.7° |
| C24 | C25 | H251 | 107.3° | 109.7° |
| C24 | C29 | N28 | 115.6° | 123.5° |
| C24 | C29 | O30 | 122.0° | 118.2° |
| C29 | C24 | H241 | 112.4° | 109.3° |
| C25 | C26 | C27 | 116.0° | 108.7° |
| C26 | C25 | H252 | 107.3° | 109.6° |
| C26 | C25 | H251 | 107.4° | 109.7° |
| C25 | C26 | H261 | 107.8° | 109.6° |
| C25 | C26 | H262 | 107.8° | 109.6° |
| C26 | C27 | N28 | 112.6° | 110.5° |
| C27 | C26 | H261 | 107.8° | 109.5° |
| C27 | C26 | H262 | 107.8° | 109.6° |
| C26 | C27 | H271 | 108.7° | 109.3° |
| C26 | C27 | H272 | 108.7° | 109.3° |
| C27 | N28 | C29 | 113.2° | 124.1° |
| N28 | C27 | H271 | 108.7° | 109.3° |
| N28 | C27 | H272 | 108.7° | 109.3° |
| C27 | N28 | H281 | 123.4° | 117.9° |
| N28 | C29 | O30 | 122.4° | 118.3° |
| C29 | N28 | H281 | 123.4° | 118.0° |
| C32 | C31 | O34 | 109.7° | 109.5° |
| C31 | C32 | O33 | 110.1° | 109.5° |
| C32 | C31 | H311 | 108.9° | 109.5° |
| C31 | C32 | H322 | 109.3° | 109.5° |
| C31 | C32 | H321 | 109.3° | 109.5° |
| O34 | C31 | H311 | 111.1° | 109.5° |
| C31 | O34 | H341 | 109.5° | 114.0° |
| O33 | C32 | H322 | 109.3° | 109.4° |
| O33 | C32 | H321 | 109.3° | 109.5° |
| C32 | O33 | H331 | 109.5° | 114.0° |
| H042 | C04 | H041 | 109.4° | 109.5° |
| H062 | C06 | H061 | 109.5° | 115.5° |
| H071 | C07 | H072 | 109.5° | 115.6° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| H252 | C25 | H251 | 109.5° | 109.7° |
| H261 | C26 | H262 | 109.5° | 109.7° |
| H271 | C27 | H272 | 109.5° | 109.2° |
| H322 | C32 | H321 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C11 | C10 | C09 | N19 | 179.9° | 179.8° |
| C10 | C11 | C12 | H111 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 179.9° | 180.0° |
| C10 | C11 | C12 | C18 | 0.0° | 0.1° |
| C11 | C10 | N19 | C18 | 0.1° | 0.5° |
| C11 | C10 | C09 | N08 | 34.2° | 180.0° |
| C11 | C10 | C09 | O20 | 145.8° | 0.1° |
| C11 | C10 | N19 | H191 | 179.8° | 179.9° |
| C09 | C10 | C11 | C12 | 180.0° | 180.0° |
| C09 | C10 | N19 | C18 | 179.9° | 179.7° |
| C10 | C09 | N08 | C03 | 179.6° | 180.0° |
| C10 | C09 | N08 | O20 | 180.0° | 180.0° |
| C09 | C10 | C11 | H111 | 0.0° | 0.1° |
| C10 | C09 | N08 | H081 | 0.3° | 0.0° |
| C09 | C10 | N19 | H191 | 0.1° | 0.3° |
| N19 | C10 | C11 | C12 | 0.1° | 0.2° |
| C10 | N19 | C18 | C12 | 0.1° | 0.5° |
| C10 | N19 | C18 | C16 | 179.8° | 180.0° |
| C10 | N19 | C18 | H191 | 180.0° | 179.5° |
| N19 | C10 | C09 | N08 | 145.9° | 0.3° |
| N19 | C10 | C09 | O20 | 34.1° | 179.7° |
| N19 | C10 | C11 | H111 | 179.9° | 179.7° |
| C11 | C12 | C13 | C18 | 179.9° | 180.0° |
| C11 | C12 | C13 | C14 | 179.9° | 180.0° |
| C11 | C12 | C18 | C16 | 179.9° | 179.9° |
| C11 | C12 | C18 | N19 | 0.1° | 0.3° |
| C11 | C12 | C13 | H131 | 0.1° | 0.1° |
| C12 | C13 | C14 | H131 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 0.0° | 0.1° |
| C13 | C12 | C18 | C16 | 0.2° | 0.1° |
| C13 | C12 | C18 | N19 | 179.9° | 179.7° |
| C13 | C12 | C11 | H111 | 0.1° | 0.0° |
| C12 | C13 | C14 | H141 | 180.0° | 180.0° |
| C18 | C12 | C13 | C14 | 0.2° | 0.1° |
| C12 | C18 | C16 | C15 | 0.1° | 0.1° |
| C12 | C18 | C16 | N19 | 180.0° | 179.5° |
| C12 | C18 | C16 | F17 | 179.8° | 179.9° |
| C18 | C12 | C11 | H111 | 180.0° | 180.0° |
| C18 | C12 | C13 | H131 | 179.8° | 180.0° |
| C12 | C18 | N19 | H191 | 179.9° | 180.0° |
| C13 | C14 | C15 | H141 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.3° | 0.1° |
| C13 | C14 | C15 | H151 | 179.7° | 179.9° |
| C14 | C15 | C16 | H151 | 180.0° | 180.0° |
| C14 | C15 | C16 | C18 | 0.3° | 0.1° |
| C14 | C15 | C16 | F17 | 179.5° | 179.9° |
| C15 | C14 | C13 | H131 | 180.0° | 179.9° |
| C15 | C16 | C18 | F17 | 179.9° | 180.0° |
| C15 | C16 | C18 | N19 | 179.9° | 179.6° |
| C16 | C15 | C14 | H141 | 179.7° | 180.0° |
| C18 | C16 | C15 | H151 | 179.7° | 179.9° |
| C16 | C18 | N19 | H191 | 0.2° | 0.5° |
| F17 | C16 | C18 | N19 | 0.3° | 0.4° |
| F17 | C16 | C15 | H151 | 0.5° | 0.0° |
| C03 | C02 | N21 | O01 | 179.9° | 180.0° |
| C02 | C03 | C04 | N08 | 120.4° | 120.0° |
| C02 | C03 | C04 | H031 | 119.5° | 119.9° |
| C02 | C03 | N08 | H031 | 118.5° | 120.0° |
| C02 | C03 | C04 | C05 | 139.5° | 175.0° |
| C02 | C03 | N08 | C09 | 65.2° | 155.0° |
| C03 | C02 | N21 | C22 | 180.0° | 180.0° |
| C02 | C03 | C04 | H042 | 100.2° | 65.0° |
| C02 | C03 | C04 | H041 | 19.3° | 55.0° |
| C02 | C03 | N08 | H081 | 114.8° | 25.0° |
| C03 | C02 | N21 | H211 | 0.0° | 0.0° |
| N21 | C02 | C03 | C04 | 111.3° | 60.0° |
| N21 | C02 | C03 | N08 | 127.1° | 180.0° |
| C02 | N21 | C22 | C23 | 130.7° | 137.6° |
| C02 | N21 | C22 | C31 | 106.4° | 102.5° |
| C02 | N21 | C22 | H211 | 180.0° | 179.9° |
| N21 | C02 | C03 | H031 | 8.2° | 59.9° |
| C02 | N21 | C22 | H221 | 12.0° | 17.6° |
| O01 | C02 | C03 | C04 | 68.7° | 120.1° |
| O01 | C02 | C03 | N08 | 52.9° | 0.0° |
| O01 | C02 | N21 | C22 | 0.0° | 0.1° |
| O01 | C02 | C03 | H031 | 171.9° | 120.0° |
| O01 | C02 | N21 | H211 | 180.0° | 180.0° |
| C04 | C03 | N08 | H031 | 119.7° | 120.0° |
| C03 | C04 | C05 | H042 | 120.3° | 119.9° |
| C03 | C04 | C05 | H041 | 120.3° | 120.0° |
| C03 | C04 | C05 | C06 | 163.6° | 175.0° |
| C03 | C04 | C05 | C07 | 95.8° | 116.4° |
| C04 | C03 | N08 | C09 | 172.9° | 85.0° |
| C03 | C04 | H042 | H041 | 119.2° | 120.0° |
| C03 | C04 | C05 | H051 | 51.2° | 29.4° |
| C04 | C03 | N08 | H081 | 7.1° | 95.0° |
| N08 | C03 | C04 | C05 | 100.0° | 64.9° |
| C03 | N08 | C09 | H081 | 180.0° | 180.0° |
| C03 | N08 | C09 | O20 | 0.4° | 0.0° |
| N08 | C03 | C04 | H042 | 20.3° | 55.0° |
| N08 | C03 | C04 | H041 | 139.7° | 175.0° |
| C04 | C05 | C06 | C07 | 106.9° | 107.5° |
| C04 | C05 | C06 | H051 | 145.0° | 145.0° |
| C04 | C05 | C07 | H051 | 146.7° | 145.1° |
| C05 | C04 | C03 | H031 | 20.1° | 55.1° |
| C05 | C04 | H042 | H041 | 119.2° | 120.0° |
| C04 | C05 | C06 | H062 | 2.5° | 0.0° |
| C04 | C05 | C06 | H061 | 143.7° | 145.0° |
| C04 | C05 | C07 | H071 | 145.2° | 145.1° |
| C04 | C05 | C07 | H072 | 4.1° | 0.0° |
| C06 | C05 | C07 | H051 | 107.9° | 107.4° |
| C05 | C06 | C07 | H062 | 109.4° | 107.5° |
| C05 | C06 | C07 | H061 | 109.4° | 107.5° |
| C06 | C05 | C04 | H042 | 43.3° | 65.1° |
| C06 | C05 | C04 | H041 | 76.1° | 55.0° |
| C05 | C06 | H062 | H061 | 144.9° | 145.7° |
| C06 | C05 | C07 | H071 | 109.4° | 107.4° |
| C06 | C05 | C07 | H072 | 109.4° | 107.5° |
| C07 | C05 | C04 | H042 | 24.5° | 3.6° |
| C07 | C05 | C04 | H041 | 143.9° | 123.6° |
| C05 | C07 | H071 | H072 | 144.8° | 145.8° |
| C07 | C06 | H062 | H061 | 145.0° | 145.7° |
| C06 | C07 | H071 | H072 | 144.8° | 145.6° |
| C09 | N08 | C03 | H031 | 53.2° | 35.0° |
| O20 | C09 | N08 | H081 | 179.7° | 180.0° |
| C23 | C22 | C31 | N21 | 119.4° | 119.9° |
| C23 | C22 | C31 | H221 | 121.5° | 120.0° |
| C23 | C22 | N21 | H221 | 118.6° | 120.0° |
| C22 | C23 | C24 | H231 | 120.4° | 120.0° |
| C22 | C23 | C24 | H232 | 120.4° | 120.0° |
| C22 | C23 | C24 | C25 | 61.5° | 65.2° |
| C22 | C23 | C24 | C29 | 179.4° | 174.4° |
| C23 | C22 | C31 | C32 | 179.2° | 180.0° |
| C23 | C22 | C31 | O34 | 59.5° | 60.0° |
| C22 | C23 | H231 | H232 | 118.7° | 120.0° |
| C22 | C23 | C24 | H241 | 60.0° | 54.6° |
| C23 | C22 | C31 | H311 | 61.9° | 60.0° |
| C23 | C22 | N21 | H211 | 49.3° | 42.5° |
| C31 | C22 | N21 | H221 | 118.5° | 120.1° |
| C31 | C22 | C23 | C24 | 179.1° | 174.0° |
| C22 | C31 | C32 | O34 | 119.1° | 120.0° |
| C22 | C31 | C32 | H311 | 119.1° | 120.0° |
| C22 | C31 | O34 | H311 | 120.2° | 120.0° |
| C22 | C31 | C32 | O33 | 160.6° | 55.0° |
| C31 | C22 | C23 | H231 | 60.5° | 66.0° |
| C31 | C22 | C23 | H232 | 58.7° | 54.0° |
| C22 | C31 | C32 | H322 | 79.3° | 175.0° |
| C22 | C31 | C32 | H321 | 40.5° | 65.0° |
| C31 | C22 | N21 | H211 | 73.6° | 77.5° |
| C22 | C31 | O34 | H341 | 180.0° | 60.1° |
| N21 | C22 | C23 | C24 | 61.4° | 66.0° |
| N21 | C22 | C31 | C32 | 61.4° | 60.0° |
| N21 | C22 | C31 | O34 | 178.9° | 180.0° |
| N21 | C22 | C23 | H231 | 59.0° | 54.0° |
| N21 | C22 | C23 | H232 | 178.1° | 174.0° |
| N21 | C22 | C31 | H311 | 57.5° | 60.0° |
| C23 | C24 | C25 | C29 | 110.1° | 120.1° |
| C23 | C24 | C25 | H241 | 119.6° | 119.9° |
| C23 | C24 | C29 | H241 | 119.7° | 119.8° |
| C23 | C24 | C25 | C26 | 140.6° | 169.0° |
| C23 | C24 | C29 | N28 | 145.5° | 137.7° |
| C23 | C24 | C29 | O30 | 34.1° | 42.3° |
| C24 | C23 | C22 | H221 | 57.7° | 54.0° |
| C24 | C23 | H231 | H232 | 118.7° | 120.1° |
| C23 | C24 | C25 | H252 | 19.4° | 49.3° |
| C23 | C24 | C25 | H251 | 98.2° | 71.3° |
| C25 | C24 | C29 | H241 | 131.0° | 120.1° |
| C24 | C25 | C26 | H252 | 121.2° | 119.7° |
| C24 | C25 | C26 | H251 | 121.2° | 119.7° |
| C24 | C25 | C26 | C27 | 14.8° | 67.6° |
| C25 | C24 | C29 | N28 | 36.3° | 17.6° |
| C25 | C24 | C29 | O30 | 143.4° | 162.4° |
| C25 | C24 | C23 | H231 | 178.1° | 174.8° |
| C25 | C24 | C23 | H232 | 58.9° | 54.7° |
| C24 | C25 | H252 | H251 | 116.2° | 120.6° |
| C24 | C25 | C26 | H261 | 106.2° | 172.7° |
| C24 | C25 | C26 | H262 | 135.8° | 52.2° |
| C29 | C24 | C25 | C26 | 30.5° | 48.9° |
| C24 | C29 | N28 | C27 | 1.5° | 2.3° |
| C24 | C29 | N28 | O30 | 179.6° | 180.0° |
| C29 | C24 | C23 | H231 | 60.2° | 54.4° |
| C29 | C24 | C23 | H232 | 59.0° | 65.7° |
| C29 | C24 | C25 | H252 | 90.7° | 70.8° |
| C29 | C24 | C25 | H251 | 151.7° | 168.6° |
| C24 | C29 | N28 | H281 | 178.5° | 177.8° |
| C25 | C26 | C27 | H261 | 121.0° | 119.8° |
| C25 | C26 | C27 | H262 | 120.9° | 119.8° |
| C25 | C26 | C27 | N28 | 55.1° | 50.8° |
| C26 | C25 | C24 | H241 | 99.8° | 71.1° |
| C26 | C25 | H252 | H251 | 116.2° | 120.5° |
| C25 | C26 | H261 | H262 | 117.0° | 120.5° |
| C25 | C26 | C27 | H271 | 175.6° | 69.5° |
| C25 | C26 | C27 | H272 | 65.3° | 171.1° |
| C26 | C27 | N28 | H271 | 120.5° | 120.3° |
| C26 | C27 | N28 | H272 | 120.4° | 120.3° |
| C26 | C27 | N28 | C29 | 46.6° | 19.1° |
| C27 | C26 | C25 | H252 | 136.0° | 52.2° |
| C27 | C26 | C25 | H251 | 106.4° | 172.7° |
| C27 | C26 | H261 | H262 | 117.0° | 120.4° |
| C26 | C27 | H271 | H272 | 118.5° | 119.6° |
| C26 | C27 | N28 | H281 | 133.4° | 161.0° |
| C27 | N28 | C29 | H281 | 180.0° | 179.9° |
| C27 | N28 | C29 | O30 | 178.9° | 177.8° |
| N28 | C27 | C26 | H261 | 65.8° | 170.5° |
| N28 | C27 | C26 | H262 | 176.1° | 69.0° |
| N28 | C27 | H271 | H272 | 118.6° | 119.5° |
| N28 | C29 | C24 | H241 | 94.8° | 102.5° |
| C29 | N28 | C27 | H271 | 167.1° | 101.2° |
| C29 | N28 | C27 | H272 | 73.8° | 139.4° |
| O30 | C29 | C24 | H241 | 85.6° | 77.5° |
| O30 | C29 | N28 | H281 | 1.1° | 2.2° |
| C32 | C31 | O34 | H311 | 120.5° | 120.0° |
| C31 | C32 | O33 | H322 | 120.1° | 120.0° |
| C31 | C32 | O33 | H321 | 120.1° | 120.1° |
| C32 | C31 | C22 | H221 | 57.6° | 60.0° |
| C31 | C32 | H322 | H321 | 119.7° | 120.1° |
| C31 | C32 | O33 | H331 | 180.0° | 180.0° |
| C32 | C31 | O34 | H341 | 60.6° | 179.9° |
| O34 | C31 | C32 | O33 | 41.5° | 65.0° |
| O34 | C31 | C22 | H221 | 62.1° | 60.0° |
| O34 | C31 | C32 | H322 | 161.6° | 55.0° |
| O34 | C31 | C32 | H321 | 78.6° | 175.0° |
| O33 | C32 | C31 | H311 | 80.3° | 175.0° |
| O33 | C32 | H322 | H321 | 119.7° | 119.9° |
| H131 | C13 | C14 | H141 | 0.0° | 0.1° |
| H141 | C14 | C15 | H151 | 0.3° | 0.0° |
| H031 | C03 | C04 | H042 | 140.4° | 175.0° |
| H031 | C03 | C04 | H041 | 100.2° | 65.0° |
| H031 | C03 | N08 | H081 | 126.8° | 145.0° |
| H042 | C04 | C05 | H051 | 171.5° | 149.3° |
| H041 | C04 | C05 | H051 | 69.1° | 90.6° |
| H051 | C05 | C06 | H062 | 142.5° | 145.0° |
| H051 | C05 | C06 | H061 | 1.3° | 0.0° |
| H051 | C05 | C07 | H071 | 1.5° | 0.0° |
| H051 | C05 | C07 | H072 | 142.6° | 145.1° |
| H062 | C06 | C07 | H071 | 141.2° | 145.0° |
| H062 | C06 | C07 | H072 | 0.0° | 0.0° |
| H061 | C06 | C07 | H071 | 0.1° | 0.0° |
| H061 | C06 | C07 | H072 | 141.2° | 145.0° |
| H221 | C22 | C23 | H231 | 178.1° | 174.1° |
| H221 | C22 | C23 | H232 | 62.7° | 66.0° |
| H221 | C22 | C31 | H311 | 176.6° | 179.9° |
| H221 | C22 | N21 | H211 | 167.9° | 162.5° |
| H231 | C23 | C24 | H241 | 60.4° | 65.4° |
| H232 | C23 | C24 | H241 | 179.6° | 174.6° |
| H241 | C24 | C25 | H252 | 139.0° | 169.2° |
| H241 | C24 | C25 | H251 | 21.4° | 48.6° |
| H252 | C25 | C26 | H261 | 15.0° | 67.5° |
| H252 | C25 | C26 | H262 | 103.0° | 171.9° |
| H251 | C25 | C26 | H261 | 132.6° | 53.0° |
| H251 | C25 | C26 | H262 | 14.6° | 67.5° |
| H261 | C26 | C27 | H271 | 54.7° | 50.3° |
| H261 | C26 | C27 | H272 | 173.7° | 69.2° |
| H262 | C26 | C27 | H271 | 63.4° | 170.7° |
| H262 | C26 | C27 | H272 | 55.6° | 51.3° |
| H271 | C27 | N28 | H281 | 12.9° | 78.7° |
| H272 | C27 | N28 | H281 | 106.2° | 40.7° |
| H311 | C31 | C32 | H322 | 39.8° | 65.0° |
| H311 | C31 | C32 | H321 | 159.6° | 55.0° |
| H311 | C31 | O34 | H341 | 59.9° | 59.9° |
| H322 | C32 | O33 | H331 | 59.9° | 60.0° |
| H321 | C32 | O33 | H331 | 59.9° | 60.0° |
