A1L4C
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | sing | 1.53Å | 1.49Å | |
| C02 | N03 | sing | 1.47Å | 1.45Å | |
| N03 | C04 | sing | 1.35Å | 1.37Å | Aromatic |
| C04 | C05 | doub | 1.36Å | 1.38Å | Aromatic |
| C05 | C06 | sing | 1.42Å | 1.45Å | Aromatic |
| C06 | N07 | doub | 1.31Å | 1.34Å | Aromatic |
| N03 | N07 | sing | 1.40Å | 1.35Å | Aromatic |
| C06 | C08 | sing | 1.48Å | 1.46Å | |
| C08 | C09 | doub | 1.39Å | 1.41Å | Aromatic |
| C09 | N10 | sing | 1.32Å | 1.35Å | Aromatic |
| N10 | C11 | doub | 1.32Å | 1.35Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.41Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C08 | C13 | sing | 1.40Å | 1.40Å | Aromatic |
| C05 | C14 | sing | 1.48Å | 1.46Å | |
| C14 | N15 | doub | 1.33Å | 1.35Å | Aromatic |
| N15 | C16 | sing | 1.32Å | 1.39Å | Aromatic |
| C16 | N17 | sing | 1.38Å | 1.39Å | |
| N17 | C18 | sing | 1.40Å | 1.45Å | |
| C18 | C19 | doub | 1.39Å | 1.41Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | doub | 1.39Å | 1.41Å | Aromatic |
| C21 | C22 | sing | 1.39Å | 1.38Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C23 | sing | 1.39Å | 1.40Å | Aromatic |
| C21 | N24 | sing | 1.40Å | 1.45Å | |
| N24 | C25 | sing | 1.47Å | 1.40Å | |
| C25 | C26 | sing | 1.53Å | 1.36Å | |
| C26 | N27 | sing | 1.47Å | 1.40Å | |
| N27 | C28 | sing | 1.47Å | 1.39Å | |
| C28 | C29 | sing | 1.53Å | 1.37Å | |
| N24 | C29 | sing | 1.47Å | 1.41Å | |
| N27 | C30 | sing | 1.47Å | 1.43Å | |
| C30 | C31 | sing | 1.54Å | 1.59Å | |
| C31 | O32 | sing | 1.44Å | 1.46Å | |
| O32 | C33 | sing | 1.44Å | 1.44Å | |
| C30 | C33 | sing | 1.54Å | 1.60Å | |
| C16 | N34 | doub | 1.33Å | 1.36Å | Aromatic |
| N34 | C35 | sing | 1.32Å | 1.37Å | Aromatic |
| C35 | C36 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | C36 | sing | 1.40Å | 1.40Å | Aromatic |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C02 | H021 | sing | 1.09Å | 1.10Å | |
| C02 | H022 | sing | 1.09Å | 1.10Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C09 | H091 | 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 | |
| C19 | H191 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.09Å | 1.10Å | |
| C31 | H311 | sing | 1.09Å | 1.10Å | |
| C31 | H312 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C35 | H351 | sing | 1.08Å | 1.08Å | |
| C36 | H361 | sing | 1.08Å | 1.08Å | |
| N17 | H171 | sing | 0.97Å | 1.00Å | |
| C25 | H1 | sing | 1.09Å | 1.10Å | |
| C26 | H2 | sing | 1.09Å | 1.10Å | |
| C28 | H3 | sing | 1.09Å | 1.10Å | |
| C29 | H4 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | N03 | 111.7° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H012 | 109.4° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| C01 | C02 | H021 | 108.9° | 109.5° |
| C01 | C02 | H022 | 108.9° | 109.5° |
| C02 | N03 | C04 | 125.7° | 125.7° |
| C02 | N03 | N07 | 123.1° | 125.8° |
| N03 | C02 | H021 | 108.9° | 109.4° |
| N03 | C02 | H022 | 108.9° | 109.5° |
| N03 | C04 | C05 | 108.1° | 107.8° |
| C04 | N03 | N07 | 111.2° | 108.5° |
| N03 | C04 | H041 | 125.9° | 126.1° |
| C04 | C05 | C06 | 104.0° | 107.4° |
| C04 | C05 | C14 | 123.0° | 126.3° |
| C05 | C04 | H041 | 126.0° | 126.0° |
| C05 | C06 | N07 | 110.2° | 107.8° |
| C05 | C06 | C08 | 132.1° | 126.1° |
| C06 | C05 | C14 | 133.0° | 126.3° |
| C06 | N07 | N03 | 106.5° | 108.5° |
| N07 | C06 | C08 | 117.7° | 126.1° |
| C06 | C08 | C09 | 121.0° | 120.5° |
| C06 | C08 | C13 | 123.3° | 120.6° |
| C08 | C09 | N10 | 124.8° | 120.5° |
| C09 | C08 | C13 | 115.7° | 118.9° |
| C08 | C09 | H091 | 117.6° | 119.7° |
| C09 | N10 | C11 | 117.6° | 121.9° |
| N10 | C09 | H091 | 117.6° | 119.7° |
| N10 | C11 | C12 | 122.2° | 121.1° |
| N10 | C11 | H111 | 118.9° | 119.5° |
| C11 | C12 | C13 | 118.9° | 119.3° |
| C12 | C11 | H111 | 118.9° | 119.5° |
| C11 | C12 | H121 | 120.5° | 120.4° |
| C12 | C13 | C08 | 120.9° | 118.3° |
| C13 | C12 | H121 | 120.6° | 120.3° |
| C12 | C13 | H131 | 119.6° | 120.8° |
| C08 | C13 | H131 | 119.5° | 120.9° |
| C05 | C14 | N15 | 119.0° | 120.5° |
| C05 | C14 | C36 | 120.5° | 120.5° |
| C14 | N15 | C16 | 119.0° | 120.6° |
| N15 | C14 | C36 | 120.3° | 119.0° |
| N15 | C16 | N17 | 119.2° | 119.1° |
| N15 | C16 | N34 | 124.1° | 121.7° |
| C16 | N17 | C18 | 128.8° | 120.0° |
| N17 | C16 | N34 | 116.7° | 119.1° |
| C16 | N17 | H171 | 115.6° | 120.0° |
| N17 | C18 | C19 | 124.5° | 120.0° |
| N17 | C18 | C23 | 120.6° | 120.0° |
| C18 | N17 | H171 | 115.6° | 120.0° |
| C18 | C19 | C20 | 122.1° | 120.0° |
| C19 | C18 | C23 | 114.9° | 120.0° |
| C18 | C19 | H191 | 118.9° | 120.0° |
| C19 | C20 | C21 | 120.9° | 120.0° |
| C20 | C19 | H191 | 118.9° | 120.0° |
| C19 | C20 | H201 | 119.5° | 120.0° |
| C20 | C21 | C22 | 116.7° | 120.0° |
| C20 | C21 | N24 | 120.0° | 120.0° |
| C21 | C20 | H201 | 119.6° | 120.0° |
| C21 | C22 | C23 | 122.2° | 120.0° |
| C22 | C21 | N24 | 123.2° | 120.0° |
| C21 | C22 | H221 | 118.9° | 120.0° |
| C22 | C23 | C18 | 123.1° | 120.0° |
| C23 | C22 | H221 | 118.9° | 120.0° |
| C22 | C23 | H231 | 118.5° | 120.1° |
| C18 | C23 | H231 | 118.5° | 120.0° |
| C21 | N24 | C25 | 120.3° | 111.0° |
| C21 | N24 | C29 | 122.7° | 111.0° |
| N24 | C25 | C26 | 121.6° | 109.3° |
| C25 | N24 | C29 | 117.0° | 110.9° |
| N24 | C25 | H251 | 106.4° | 109.5° |
| N24 | C25 | H1 | 106.4° | 109.5° |
| C25 | C26 | N27 | 121.1° | 109.4° |
| C26 | C25 | H251 | 106.4° | 109.4° |
| C25 | C26 | H261 | 106.5° | 109.5° |
| C26 | C25 | H1 | 106.4° | 109.5° |
| C25 | C26 | H2 | 106.5° | 109.5° |
| C26 | N27 | C28 | 118.1° | 110.9° |
| C26 | N27 | C30 | 121.4° | 111.0° |
| N27 | C26 | H261 | 106.5° | 109.5° |
| N27 | C26 | H2 | 106.5° | 109.5° |
| N27 | C28 | C29 | 120.8° | 109.4° |
| C28 | N27 | C30 | 120.5° | 111.0° |
| N27 | C28 | H281 | 106.6° | 109.4° |
| N27 | C28 | H3 | 106.6° | 109.5° |
| C28 | C29 | N24 | 121.5° | 109.3° |
| C29 | C28 | H281 | 106.6° | 109.5° |
| C28 | C29 | H291 | 106.4° | 109.5° |
| C29 | C28 | H3 | 106.5° | 109.5° |
| C28 | C29 | H4 | 106.4° | 109.5° |
| N24 | C29 | H291 | 106.4° | 109.5° |
| N24 | C29 | H4 | 106.4° | 109.5° |
| N27 | C30 | C31 | 115.3° | 113.8° |
| N27 | C30 | C33 | 116.6° | 113.8° |
| N27 | C30 | H301 | 115.1° | 113.1° |
| C30 | C31 | O32 | 89.5° | 85.5° |
| C31 | C30 | C33 | 80.4° | 85.8° |
| C31 | C30 | H301 | 112.5° | 113.8° |
| C30 | C31 | H311 | 114.2° | 113.9° |
| C30 | C31 | H312 | 114.2° | 113.8° |
| C31 | O32 | C33 | 90.7° | 93.3° |
| O32 | C31 | H311 | 114.2° | 113.9° |
| O32 | C31 | H312 | 114.2° | 113.8° |
| O32 | C33 | C30 | 89.5° | 85.5° |
| O32 | C33 | H331 | 114.2° | 113.8° |
| O32 | C33 | H332 | 114.2° | 114.0° |
| C33 | C30 | H301 | 112.3° | 113.8° |
| C30 | C33 | H331 | 114.2° | 113.9° |
| C30 | C33 | H332 | 114.2° | 113.9° |
| C16 | N34 | C35 | 114.9° | 120.9° |
| N34 | C35 | C36 | 124.7° | 119.4° |
| N34 | C35 | H351 | 117.7° | 120.3° |
| C35 | C36 | C14 | 117.0° | 118.4° |
| C36 | C35 | H351 | 117.7° | 120.3° |
| C35 | C36 | H361 | 121.5° | 120.8° |
| C14 | C36 | H361 | 121.5° | 120.8° |
| H011 | C01 | H012 | 109.5° | 109.5° |
| H011 | C01 | H013 | 109.5° | 109.4° |
| H012 | C01 | H013 | 109.5° | 109.5° |
| H021 | C02 | H022 | 109.5° | 109.5° |
| H251 | C25 | H1 | 109.5° | 109.5° |
| H261 | C26 | H2 | 109.5° | 109.5° |
| H281 | C28 | H3 | 109.5° | 109.4° |
| H291 | C29 | H4 | 109.5° | 109.5° |
| H311 | C31 | H312 | 109.4° | 113.1° |
| H331 | C33 | H332 | 109.5° | 113.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | N03 | H021 | 120.4° | 120.0° |
| C01 | C02 | N03 | H022 | 120.3° | 120.0° |
| C01 | C02 | N03 | C04 | 120.7° | 125.0° |
| C01 | C02 | N03 | N07 | 59.2° | 54.6° |
| C02 | C01 | H011 | H012 | 120.0° | 120.0° |
| C02 | C01 | H011 | H013 | 120.0° | 120.0° |
| C02 | C01 | H012 | H013 | 120.0° | 120.0° |
| C01 | C02 | H021 | H022 | 119.0° | 120.0° |
| C02 | N03 | C04 | N07 | 179.9° | 179.7° |
| C02 | N03 | C04 | C05 | 179.7° | 180.0° |
| C02 | N03 | N07 | C06 | 179.5° | 179.9° |
| N03 | C02 | C01 | H011 | 180.0° | 60.0° |
| N03 | C02 | C01 | H012 | 60.0° | 180.0° |
| N03 | C02 | C01 | H013 | 60.0° | 60.0° |
| N03 | C02 | H021 | H022 | 118.9° | 120.0° |
| C02 | N03 | C04 | H041 | 0.3° | 0.2° |
| N03 | C04 | C05 | H041 | 180.0° | 179.8° |
| N03 | C04 | C05 | C06 | 0.8° | 0.2° |
| C04 | N03 | N07 | C06 | 0.6° | 0.4° |
| N03 | C04 | C05 | C14 | 178.7° | 179.8° |
| C04 | N03 | C02 | H021 | 119.0° | 5.0° |
| C04 | N03 | C02 | H022 | 0.4° | 115.0° |
| C04 | C05 | C06 | C14 | 177.5° | 180.0° |
| C04 | C05 | C06 | N07 | 1.2° | 0.0° |
| C05 | C04 | N03 | N07 | 0.2° | 0.4° |
| C04 | C05 | C06 | C08 | 179.0° | 180.0° |
| C04 | C05 | C14 | N15 | 33.1° | 173.6° |
| C04 | C05 | C14 | C36 | 142.4° | 6.6° |
| C05 | C06 | N07 | C08 | 178.1° | 180.0° |
| C05 | C06 | N07 | N03 | 1.1° | 0.3° |
| C05 | C06 | C08 | C09 | 141.2° | 45.8° |
| C05 | C06 | C08 | C13 | 39.7° | 134.6° |
| C06 | C05 | C14 | N15 | 149.7° | 6.4° |
| C06 | C05 | C14 | C36 | 34.8° | 173.4° |
| C06 | C05 | C04 | H041 | 179.2° | 180.0° |
| N07 | C06 | C08 | C09 | 41.1° | 134.3° |
| N07 | C06 | C08 | C13 | 138.0° | 45.4° |
| N07 | C06 | C05 | C14 | 178.8° | 180.0° |
| N03 | N07 | C06 | C08 | 179.3° | 179.8° |
| N07 | N03 | C02 | H021 | 61.2° | 174.6° |
| N07 | N03 | C02 | H022 | 179.5° | 65.4° |
| N07 | N03 | C04 | H041 | 179.8° | 179.8° |
| C06 | C08 | C09 | C13 | 179.1° | 179.7° |
| C06 | C08 | C09 | N10 | 179.5° | 180.0° |
| C06 | C08 | C13 | C12 | 178.8° | 180.0° |
| C08 | C06 | C05 | C14 | 3.5° | 0.0° |
| C06 | C08 | C09 | H091 | 0.5° | 0.1° |
| C06 | C08 | C13 | H131 | 1.2° | 0.0° |
| C08 | C09 | N10 | H091 | 180.0° | 180.0° |
| C08 | C09 | N10 | C11 | 0.9° | 0.0° |
| C09 | C08 | C13 | C12 | 0.3° | 0.3° |
| C09 | C08 | C13 | H131 | 179.7° | 179.7° |
| C09 | N10 | C11 | C12 | 0.8° | 0.3° |
| N10 | C09 | C08 | C13 | 0.3° | 0.3° |
| C09 | N10 | C11 | H111 | 179.2° | 179.9° |
| N10 | C11 | C12 | H111 | 180.0° | 179.8° |
| N10 | C11 | C12 | C13 | 0.2° | 0.2° |
| C11 | N10 | C09 | H091 | 179.1° | 180.0° |
| N10 | C11 | C12 | H121 | 179.8° | 179.8° |
| C11 | C12 | C13 | H121 | 180.0° | 180.0° |
| C11 | C12 | C13 | C08 | 0.4° | 0.0° |
| C11 | C12 | C13 | H131 | 179.6° | 180.0° |
| C12 | C13 | C08 | H131 | 180.0° | 180.0° |
| C13 | C12 | C11 | H111 | 179.8° | 180.0° |
| C13 | C08 | C09 | H091 | 179.7° | 179.7° |
| C08 | C13 | C12 | H121 | 179.7° | 179.9° |
| C05 | C14 | N15 | C36 | 175.5° | 179.8° |
| C05 | C14 | N15 | C16 | 178.4° | 180.0° |
| C05 | C14 | C36 | C35 | 177.7° | 180.0° |
| C14 | C05 | C04 | H041 | 1.3° | 0.0° |
| C05 | C14 | C36 | H361 | 2.3° | 0.1° |
| C14 | N15 | C16 | N17 | 178.1° | 180.0° |
| C14 | N15 | C16 | N34 | 1.7° | 0.0° |
| N15 | C14 | C36 | C35 | 2.3° | 0.2° |
| N15 | C14 | C36 | H361 | 177.7° | 179.7° |
| N15 | C16 | N17 | N34 | 179.8° | 180.0° |
| N15 | C16 | N17 | C18 | 17.8° | 174.2° |
| N15 | C16 | N34 | C35 | 0.0° | 0.2° |
| C16 | N15 | C14 | C36 | 2.9° | 0.2° |
| N15 | C16 | N17 | H171 | 162.2° | 5.8° |
| C16 | N17 | C18 | H171 | 180.0° | 179.9° |
| C16 | N17 | C18 | C19 | 19.5° | 142.8° |
| C16 | N17 | C18 | C23 | 160.6° | 37.5° |
| N17 | C16 | N34 | C35 | 179.8° | 179.8° |
| N17 | C18 | C19 | C23 | 179.9° | 179.8° |
| N17 | C18 | C19 | C20 | 179.5° | 179.8° |
| N17 | C18 | C23 | C22 | 179.5° | 179.7° |
| C18 | N17 | C16 | N34 | 162.4° | 5.7° |
| N17 | C18 | C19 | H191 | 0.4° | 0.3° |
| N17 | C18 | C23 | H231 | 0.5° | 0.2° |
| C18 | C19 | C20 | H191 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.6° | 0.1° |
| C19 | C18 | C23 | C22 | 0.6° | 0.1° |
| C18 | C19 | C20 | H201 | 179.4° | 179.9° |
| C19 | C18 | C23 | H231 | 179.4° | 179.9° |
| C19 | C18 | N17 | H171 | 160.5° | 37.1° |
| C19 | C20 | C21 | H201 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.6° | 0.1° |
| C20 | C19 | C18 | C23 | 0.6° | 0.0° |
| C19 | C20 | C21 | N24 | 178.8° | 179.9° |
| C20 | C21 | C22 | N24 | 178.1° | 179.9° |
| C20 | C21 | C22 | C23 | 0.7° | 0.0° |
| C20 | C21 | N24 | C25 | 39.2° | 180.0° |
| C20 | C21 | N24 | C29 | 139.0° | 56.1° |
| C21 | C20 | C19 | H191 | 179.4° | 180.0° |
| C20 | C21 | C22 | H221 | 179.3° | 180.0° |
| C21 | C22 | C23 | H221 | 180.0° | 180.0° |
| C21 | C22 | C23 | C18 | 0.7° | 0.1° |
| C22 | C21 | N24 | C25 | 142.8° | 0.1° |
| C22 | C21 | N24 | C29 | 39.0° | 123.8° |
| C22 | C21 | C20 | H201 | 179.4° | 179.9° |
| C21 | C22 | C23 | H231 | 179.2° | 179.9° |
| C22 | C23 | C18 | H231 | 180.0° | 179.9° |
| C23 | C22 | C21 | N24 | 178.8° | 179.9° |
| C23 | C18 | C19 | H191 | 179.5° | 179.9° |
| C18 | C23 | C22 | H221 | 179.3° | 180.0° |
| C23 | C18 | N17 | H171 | 19.4° | 142.6° |
| C21 | N24 | C25 | C29 | 178.2° | 123.9° |
| C21 | N24 | C25 | C26 | 178.4° | 176.8° |
| C21 | N24 | C29 | C28 | 179.1° | 176.8° |
| N24 | C21 | C20 | H201 | 1.3° | 0.1° |
| N24 | C21 | C22 | H221 | 1.2° | 0.1° |
| C21 | N24 | C25 | H251 | 56.8° | 63.3° |
| C21 | N24 | C29 | H291 | 57.5° | 56.8° |
| C21 | N24 | C25 | H1 | 59.9° | 56.8° |
| C21 | N24 | C29 | H4 | 59.2° | 63.2° |
| N24 | C25 | C26 | H251 | 121.7° | 119.9° |
| N24 | C25 | C26 | H1 | 121.7° | 120.0° |
| N24 | C25 | C26 | N27 | 0.8° | 58.4° |
| C25 | N24 | C29 | C28 | 0.9° | 59.3° |
| N24 | C25 | H251 | H1 | 114.6° | 120.1° |
| N24 | C25 | C26 | H261 | 120.8° | 61.6° |
| C25 | N24 | C29 | H291 | 120.7° | 179.3° |
| N24 | C25 | C26 | H2 | 122.4° | 178.4° |
| C25 | N24 | C29 | H4 | 122.6° | 60.7° |
| C25 | C26 | N27 | H261 | 121.6° | 120.0° |
| C25 | C26 | N27 | H2 | 121.6° | 120.0° |
| C25 | C26 | N27 | C28 | 1.1° | 59.3° |
| C26 | C25 | N24 | C29 | 0.2° | 59.3° |
| C25 | C26 | N27 | C30 | 179.8° | 176.8° |
| C26 | C25 | H251 | H1 | 114.5° | 120.1° |
| C25 | C26 | H261 | H2 | 114.7° | 120.0° |
| C26 | N27 | C28 | C30 | 179.1° | 123.8° |
| C26 | N27 | C28 | C29 | 0.3° | 59.3° |
| C26 | N27 | C30 | C31 | 22.0° | 180.0° |
| C26 | N27 | C30 | C33 | 69.7° | 83.8° |
| N27 | C26 | C25 | H251 | 122.5° | 61.6° |
| N27 | C26 | H261 | H2 | 114.8° | 120.1° |
| C26 | N27 | C28 | H281 | 121.3° | 179.3° |
| C26 | N27 | C30 | H301 | 155.5° | 48.1° |
| N27 | C26 | C25 | H1 | 120.9° | 178.4° |
| C26 | N27 | C28 | H3 | 121.9° | 60.7° |
| N27 | C28 | C29 | H281 | 121.6° | 119.9° |
| N27 | C28 | C29 | H3 | 121.6° | 120.1° |
| N27 | C28 | C29 | N24 | 0.7° | 58.4° |
| C28 | N27 | C30 | C31 | 158.9° | 56.2° |
| C28 | N27 | C30 | C33 | 109.4° | 152.4° |
| C28 | N27 | C26 | H261 | 120.6° | 60.7° |
| N27 | C28 | H281 | H3 | 114.9° | 120.0° |
| N27 | C28 | C29 | H291 | 121.0° | 178.4° |
| C28 | N27 | C30 | H301 | 25.4° | 75.7° |
| C28 | N27 | C26 | H2 | 122.7° | 179.3° |
| N27 | C28 | C29 | H4 | 122.3° | 61.6° |
| C28 | C29 | N24 | H291 | 121.7° | 120.0° |
| C28 | C29 | N24 | H4 | 121.7° | 120.0° |
| C29 | C28 | N27 | C30 | 179.4° | 176.8° |
| C29 | C28 | H281 | H3 | 114.9° | 120.0° |
| C28 | C29 | H291 | H4 | 114.6° | 120.1° |
| C29 | N24 | C25 | H251 | 121.5° | 60.6° |
| N24 | C29 | C28 | H281 | 122.3° | 178.4° |
| N24 | C29 | H291 | H4 | 114.6° | 120.0° |
| C29 | N24 | C25 | H1 | 121.9° | 179.3° |
| N24 | C29 | C28 | H3 | 120.9° | 61.6° |
| N27 | C30 | C31 | C33 | 115.0° | 114.2° |
| N27 | C30 | C31 | H301 | 134.7° | 131.6° |
| N27 | C30 | C31 | O32 | 137.3° | 136.8° |
| N27 | C30 | C33 | O32 | 136.1° | 136.8° |
| N27 | C30 | C33 | H301 | 136.0° | 131.5° |
| C30 | N27 | C26 | H261 | 58.5° | 63.2° |
| C30 | N27 | C28 | H281 | 57.8° | 56.8° |
| N27 | C30 | C31 | H311 | 20.8° | 22.6° |
| N27 | C30 | C31 | H312 | 106.2° | 109.1° |
| N27 | C30 | C33 | H331 | 19.7° | 109.1° |
| N27 | C30 | C33 | H332 | 107.4° | 22.5° |
| C30 | N27 | C26 | H2 | 58.2° | 56.8° |
| C30 | N27 | C28 | H3 | 59.0° | 63.1° |
| C30 | C31 | O32 | H311 | 116.5° | 114.2° |
| C30 | C31 | O32 | H312 | 116.5° | 114.1° |
| C31 | C30 | C33 | O32 | 22.6° | 22.6° |
| C31 | C30 | C33 | H301 | 110.5° | 114.3° |
| C30 | C31 | H311 | H312 | 129.5° | 132.0° |
| C31 | C30 | C33 | H331 | 93.9° | 136.7° |
| C31 | C30 | C33 | H332 | 139.0° | 91.7° |
| O32 | C31 | C30 | H301 | 88.0° | 91.6° |
| O32 | C31 | H311 | H312 | 129.5° | 132.1° |
| C31 | O32 | C33 | H331 | 92.1° | 138.4° |
| C31 | O32 | C33 | H332 | 140.9° | 90.0° |
| O32 | C33 | C30 | H331 | 116.5° | 114.1° |
| O32 | C33 | C30 | H332 | 116.5° | 114.3° |
| O32 | C33 | C30 | H301 | 87.9° | 91.6° |
| C33 | O32 | C31 | H311 | 91.9° | 89.9° |
| C33 | O32 | C31 | H312 | 141.1° | 138.3° |
| O32 | C33 | H331 | H332 | 129.5° | 132.1° |
| C33 | C30 | C31 | H311 | 94.2° | 91.6° |
| C33 | C30 | C31 | H312 | 138.7° | 136.7° |
| C30 | C33 | H331 | H332 | 129.5° | 132.0° |
| C16 | N34 | C35 | C36 | 0.6° | 0.2° |
| C16 | N34 | C35 | H351 | 179.5° | 179.7° |
| N34 | C16 | N17 | H171 | 17.6° | 174.2° |
| N34 | C35 | C36 | H351 | 180.0° | 180.0° |
| N34 | C35 | C36 | C14 | 0.5° | 0.0° |
| N34 | C35 | C36 | H361 | 179.5° | 179.9° |
| C35 | C36 | C14 | H361 | 180.0° | 179.9° |
| C14 | C36 | C35 | H351 | 179.4° | 180.0° |
| H011 | C01 | H012 | H013 | 120.0° | 120.0° |
| H011 | C01 | C02 | H021 | 59.6° | 180.0° |
| H011 | C01 | C02 | H022 | 59.7° | 60.0° |
| H012 | C01 | C02 | H021 | 60.4° | 60.0° |
| H012 | C01 | C02 | H022 | 179.7° | 60.0° |
| H013 | C01 | C02 | H021 | 179.6° | 60.0° |
| H013 | C01 | C02 | H022 | 60.3° | 179.9° |
| H111 | C11 | C12 | H121 | 0.2° | 0.0° |
| H121 | C12 | C13 | H131 | 0.3° | 0.1° |
| H191 | C19 | C20 | H201 | 0.5° | 0.0° |
| H221 | C22 | C23 | H231 | 0.7° | 0.1° |
| H251 | C25 | C26 | H261 | 0.8° | 178.5° |
| H251 | C25 | C26 | H2 | 115.9° | 58.4° |
| H261 | C26 | C25 | H1 | 117.5° | 58.4° |
| H281 | C28 | C29 | H291 | 0.6° | 61.7° |
| H281 | C28 | C29 | H4 | 116.1° | 58.4° |
| H291 | C29 | C28 | H3 | 117.4° | 58.3° |
| H301 | C30 | C31 | H311 | 155.5° | 154.2° |
| H301 | C30 | C31 | H312 | 28.5° | 22.5° |
| H301 | C30 | C33 | H331 | 155.6° | 22.4° |
| H301 | C30 | C33 | H332 | 28.6° | 154.1° |
| H351 | C35 | C36 | H361 | 0.5° | 0.0° |
| H1 | C25 | C26 | H2 | 0.7° | 61.6° |
| H3 | C28 | C29 | H4 | 0.8° | 178.4° |
