A1ARR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C10 | doub | 1.21Å | 1.21Å | |
| C10 | N2 | sing | 1.34Å | 1.33Å | |
| C10 | C7 | sing | 1.51Å | 1.50Å | |
| N2 | C9 | sing | 1.47Å | 1.45Å | |
| C9 | C8 | sing | 1.55Å | 1.53Å | |
| C8 | C7 | sing | 1.55Å | 1.52Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C6 | C4 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C4 | N1 | sing | 1.47Å | 1.47Å | |
| O2 | C5 | sing | 1.43Å | 1.44Å | |
| C32 | C5 | sing | 1.51Å | 1.50Å | |
| N1 | C3 | sing | 1.35Å | 1.34Å | |
| O1 | C3 | doub | 1.21Å | 1.22Å | |
| C3 | C2 | sing | 1.51Å | 1.50Å | |
| C11 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | N | sing | 1.46Å | 1.46Å | |
| C12 | C11 | sing | 1.53Å | 1.53Å | |
| C12 | C21 | sing | 1.53Å | 1.53Å | |
| C25 | C12 | sing | 1.53Å | 1.53Å | |
| C21 | C22 | sing | 1.53Å | 1.53Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| N | C1 | sing | 1.35Å | 1.33Å | |
| O | C1 | doub | 1.21Å | 1.22Å | |
| C1 | C | sing | 1.51Å | 1.50Å | |
| C13 | C | sing | 1.53Å | 1.53Å | |
| C | N3 | sing | 1.46Å | 1.45Å | |
| C14 | C13 | sing | 1.53Å | 1.53Å | |
| O4 | C13 | sing | 1.43Å | 1.44Å | |
| C17 | O4 | sing | 1.43Å | 1.44Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C19 | C17 | sing | 1.53Å | 1.53Å | |
| C20 | C17 | sing | 1.53Å | 1.53Å | |
| N3 | C15 | sing | 1.35Å | 1.34Å | |
| C15 | O6 | doub | 1.21Å | 1.23Å | |
| O5 | C15 | sing | 1.35Å | 1.46Å | |
| C16 | O5 | sing | 1.45Å | 1.43Å | |
| C26 | C16 | sing | 1.51Å | 1.52Å | |
| C26 | C27 | doub | 1.38Å | 1.40Å | Aromatic |
| C31 | C26 | sing | 1.38Å | 1.40Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.40Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C29 | C30 | sing | 1.38Å | 1.39Å | Aromatic |
| C30 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| C32 | N33 | doub | 1.30Å | 1.36Å | Aromatic |
| O36 | C32 | sing | 1.34Å | 1.36Å | Aromatic |
| N33 | C34 | sing | 1.36Å | 1.37Å | Aromatic |
| C34 | C35 | doub | 1.40Å | 1.40Å | Aromatic |
| C34 | C40 | sing | 1.40Å | 1.39Å | Aromatic |
| C35 | O36 | sing | 1.35Å | 1.32Å | Aromatic |
| C37 | C35 | sing | 1.39Å | 1.40Å | Aromatic |
| C38 | C37 | doub | 1.38Å | 1.40Å | Aromatic |
| C39 | C38 | sing | 1.39Å | 1.40Å | Aromatic |
| C40 | C39 | doub | 1.38Å | 1.40Å | Aromatic |
| N | HN | sing | 0.97Å | 1.00Å | |
| C | H0 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H143 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H183 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H203 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | 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 | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C39 | H39 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C40 | H40 | sing | 1.08Å | 1.08Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H82 | sing | 1.09Å | 1.10Å | |
| C8 | H81 | sing | 1.09Å | 1.10Å | |
| C9 | H92 | sing | 1.09Å | 1.10Å | |
| C9 | H91 | sing | 1.09Å | 1.10Å | |
| N1 | HN1 | sing | 0.97Å | 1.00Å | |
| N2 | HN2 | sing | 0.97Å | 1.00Å | |
| N3 | HN3 | sing | 0.97Å | 1.00Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C10 | N2 | 126.4° | 125.0° |
| O3 | C10 | C7 | 121.6° | 124.9° |
| N2 | C10 | C7 | 111.9° | 110.2° |
| C10 | N2 | C9 | 111.5° | 111.3° |
| C10 | N2 | HN2 | 124.3° | 124.3° |
| C10 | C7 | C8 | 102.7° | 104.2° |
| C10 | C7 | C6 | 110.9° | 110.5° |
| C10 | C7 | H7 | 110.2° | 110.5° |
| N2 | C9 | C8 | 104.8° | 105.5° |
| N2 | C9 | H92 | 110.6° | 110.3° |
| N2 | C9 | H91 | 110.6° | 110.3° |
| C9 | N2 | HN2 | 124.2° | 124.4° |
| C9 | C8 | C7 | 104.9° | 101.7° |
| C9 | C8 | H82 | 110.6° | 111.0° |
| C9 | C8 | H81 | 110.6° | 111.0° |
| C8 | C9 | H92 | 110.6° | 110.2° |
| C8 | C9 | H91 | 110.6° | 110.2° |
| C8 | C7 | C6 | 113.1° | 110.4° |
| C8 | C7 | H7 | 109.9° | 110.6° |
| C7 | C8 | H82 | 110.6° | 111.0° |
| C7 | C8 | H81 | 110.6° | 111.0° |
| C7 | C6 | C4 | 109.4° | 109.4° |
| C7 | C6 | H61 | 109.5° | 109.5° |
| C7 | C6 | H62 | 109.5° | 109.5° |
| C6 | C7 | H7 | 109.8° | 110.5° |
| C6 | C4 | C5 | 112.2° | 109.5° |
| C6 | C4 | N1 | 111.2° | 109.4° |
| C6 | C4 | H4 | 108.3° | 109.5° |
| C4 | C6 | H61 | 109.5° | 109.5° |
| C4 | C6 | H62 | 109.5° | 109.5° |
| C5 | C4 | N1 | 107.7° | 109.4° |
| C4 | C5 | O2 | 112.1° | 109.5° |
| C4 | C5 | C32 | 105.7° | 109.4° |
| C5 | C4 | H4 | 108.3° | 109.5° |
| C4 | C5 | H1 | 108.8° | 109.5° |
| C4 | N1 | C3 | 120.2° | 120.0° |
| N1 | C4 | H4 | 109.1° | 109.5° |
| C4 | N1 | HN1 | 119.9° | 120.1° |
| O2 | C5 | C32 | 110.9° | 109.5° |
| O2 | C5 | H1 | 110.0° | 109.5° |
| C5 | O2 | HO2 | 109.5° | 114.0° |
| C5 | C32 | N33 | 123.7° | 124.8° |
| C5 | C32 | O36 | 123.1° | 124.9° |
| C32 | C5 | H1 | 109.1° | 109.5° |
| N1 | C3 | O1 | 122.0° | 120.0° |
| N1 | C3 | C2 | 118.6° | 120.0° |
| C3 | N1 | HN1 | 119.9° | 119.9° |
| O1 | C3 | C2 | 119.5° | 120.0° |
| C3 | C2 | C11 | 109.3° | 109.5° |
| C3 | C2 | N | 111.0° | 109.5° |
| C3 | C2 | H2 | 108.8° | 109.4° |
| C11 | C2 | N | 109.7° | 109.5° |
| C2 | C11 | C12 | 111.8° | 109.5° |
| C2 | C11 | H111 | 108.9° | 109.5° |
| C2 | C11 | H112 | 108.9° | 109.5° |
| C11 | C2 | H2 | 108.5° | 109.5° |
| C2 | N | C1 | 119.0° | 120.0° |
| C2 | N | HN | 120.5° | 120.0° |
| N | C2 | H2 | 109.5° | 109.5° |
| C11 | C12 | C21 | 110.4° | 109.5° |
| C11 | C12 | C25 | 109.2° | 109.5° |
| C12 | C11 | H111 | 108.9° | 109.5° |
| C12 | C11 | H112 | 108.9° | 109.5° |
| C11 | C12 | H12 | 109.2° | 109.5° |
| C21 | C12 | C25 | 109.6° | 109.5° |
| C12 | C21 | C22 | 110.9° | 109.5° |
| C21 | C12 | H12 | 109.2° | 109.4° |
| C12 | C21 | H211 | 109.1° | 109.4° |
| C12 | C21 | H212 | 109.1° | 109.5° |
| C12 | C25 | C24 | 110.5° | 109.5° |
| C25 | C12 | H12 | 109.2° | 109.5° |
| C12 | C25 | H252 | 109.2° | 109.5° |
| C12 | C25 | H251 | 109.2° | 109.5° |
| C21 | C22 | C23 | 111.8° | 109.5° |
| C22 | C21 | H211 | 109.1° | 109.5° |
| C22 | C21 | H212 | 109.1° | 109.5° |
| C21 | C22 | H222 | 108.9° | 109.5° |
| C21 | C22 | H221 | 108.9° | 109.4° |
| C22 | C23 | C24 | 113.0° | 109.5° |
| C23 | C22 | H222 | 108.9° | 109.5° |
| C23 | C22 | H221 | 108.9° | 109.5° |
| C22 | C23 | H232 | 108.6° | 109.4° |
| C22 | C23 | H231 | 108.6° | 109.4° |
| C23 | C24 | C25 | 109.7° | 109.4° |
| C24 | C23 | H232 | 108.6° | 109.5° |
| C24 | C23 | H231 | 108.6° | 109.5° |
| C23 | C24 | H242 | 109.4° | 109.5° |
| C23 | C24 | H241 | 109.4° | 109.5° |
| C25 | C24 | H242 | 109.4° | 109.5° |
| C25 | C24 | H241 | 109.4° | 109.4° |
| C24 | C25 | H252 | 109.2° | 109.4° |
| C24 | C25 | H251 | 109.2° | 109.5° |
| N | C1 | O | 121.3° | 120.0° |
| N | C1 | C | 118.4° | 120.0° |
| C1 | N | HN | 120.5° | 120.0° |
| O | C1 | C | 120.2° | 120.0° |
| C1 | C | C13 | 109.0° | 109.5° |
| C1 | C | N3 | 109.7° | 109.5° |
| C1 | C | H0 | 109.0° | 109.5° |
| C13 | C | N3 | 110.9° | 109.5° |
| C | C13 | C14 | 109.4° | 109.5° |
| C | C13 | O4 | 110.5° | 109.5° |
| C13 | C | H0 | 108.5° | 109.5° |
| C | C13 | H13 | 108.7° | 109.5° |
| C | N3 | C15 | 124.5° | 120.0° |
| N3 | C | H0 | 109.7° | 109.5° |
| C | N3 | HN3 | 117.7° | 120.0° |
| C14 | C13 | O4 | 109.5° | 109.5° |
| C14 | C13 | H13 | 108.7° | 109.5° |
| C13 | C14 | H142 | 109.5° | 109.5° |
| C13 | C14 | H141 | 109.5° | 109.4° |
| C13 | C14 | H143 | 109.5° | 109.5° |
| C13 | O4 | C17 | 118.1° | 114.0° |
| O4 | C13 | H13 | 110.0° | 109.5° |
| O4 | C17 | C18 | 109.7° | 109.5° |
| O4 | C17 | C19 | 108.1° | 109.4° |
| O4 | C17 | C20 | 112.2° | 109.4° |
| C18 | C17 | C19 | 110.2° | 109.5° |
| C18 | C17 | C20 | 108.3° | 109.5° |
| C17 | C18 | H182 | 109.5° | 109.4° |
| C17 | C18 | H183 | 109.5° | 109.5° |
| C17 | C18 | H181 | 109.5° | 109.5° |
| C19 | C17 | C20 | 108.4° | 109.5° |
| C17 | C19 | H191 | 109.5° | 109.5° |
| C17 | C19 | H192 | 109.4° | 109.4° |
| C17 | C19 | H193 | 109.5° | 109.5° |
| C17 | C20 | H201 | 109.5° | 109.5° |
| C17 | C20 | H203 | 109.5° | 109.4° |
| C17 | C20 | H202 | 109.5° | 109.4° |
| N3 | C15 | O6 | 124.3° | 120.0° |
| N3 | C15 | O5 | 117.1° | 120.0° |
| C15 | N3 | HN3 | 117.7° | 120.0° |
| O6 | C15 | O5 | 118.5° | 120.0° |
| C15 | O5 | C16 | 120.1° | 117.0° |
| O5 | C16 | C26 | 112.1° | 109.5° |
| O5 | C16 | H162 | 108.8° | 109.5° |
| O5 | C16 | H161 | 108.8° | 109.5° |
| C16 | C26 | C27 | 119.8° | 120.0° |
| C16 | C26 | C31 | 120.4° | 120.0° |
| C26 | C16 | H162 | 108.8° | 109.5° |
| C26 | C16 | H161 | 108.8° | 109.5° |
| C27 | C26 | C31 | 119.8° | 120.0° |
| C26 | C27 | C28 | 119.4° | 120.0° |
| C26 | C27 | H27 | 120.3° | 120.0° |
| C26 | C31 | C30 | 120.2° | 120.0° |
| C26 | C31 | H31 | 119.9° | 120.0° |
| C27 | C28 | C29 | 120.9° | 120.0° |
| C28 | C27 | H27 | 120.3° | 120.0° |
| C27 | C28 | H28 | 119.5° | 120.0° |
| C28 | C29 | C30 | 119.6° | 120.0° |
| C29 | C28 | H28 | 119.6° | 120.0° |
| C28 | C29 | H29 | 120.2° | 120.0° |
| C29 | C30 | C31 | 120.1° | 120.0° |
| C30 | C29 | H29 | 120.2° | 119.9° |
| C29 | C30 | H30 | 119.9° | 120.1° |
| C31 | C30 | H30 | 120.0° | 120.0° |
| C30 | C31 | H31 | 119.9° | 120.0° |
| N33 | C32 | O36 | 113.1° | 110.3° |
| C32 | N33 | C34 | 105.1° | 108.8° |
| C32 | O36 | C35 | 103.8° | 108.2° |
| N33 | C34 | C35 | 106.1° | 106.5° |
| N33 | C34 | C40 | 134.2° | 133.8° |
| C35 | C34 | C40 | 119.7° | 119.7° |
| C34 | C35 | O36 | 111.8° | 106.2° |
| C34 | C35 | C37 | 123.2° | 119.8° |
| C34 | C40 | C39 | 118.6° | 119.7° |
| C34 | C40 | H40 | 120.7° | 120.2° |
| O36 | C35 | C37 | 125.0° | 133.9° |
| C35 | C37 | C38 | 115.9° | 119.9° |
| C35 | C37 | H37 | 122.0° | 120.1° |
| C37 | C38 | C39 | 121.7° | 120.5° |
| C38 | C37 | H37 | 122.0° | 120.0° |
| C37 | C38 | H38 | 119.2° | 119.8° |
| C38 | C39 | C40 | 120.9° | 120.4° |
| C39 | C38 | H38 | 119.2° | 119.8° |
| C38 | C39 | H39 | 119.6° | 119.8° |
| C40 | C39 | H39 | 119.5° | 119.8° |
| C39 | C40 | H40 | 120.7° | 120.2° |
| H111 | C11 | H112 | 109.5° | 109.4° |
| H142 | C14 | H141 | 109.4° | 109.4° |
| H142 | C14 | H143 | 109.4° | 109.5° |
| H141 | C14 | H143 | 109.5° | 109.5° |
| H162 | C16 | H161 | 109.5° | 109.5° |
| H182 | C18 | H183 | 109.4° | 109.5° |
| H182 | C18 | H181 | 109.5° | 109.5° |
| H183 | C18 | H181 | 109.5° | 109.5° |
| H191 | C19 | H192 | 109.5° | 109.5° |
| H191 | C19 | H193 | 109.5° | 109.5° |
| H192 | C19 | H193 | 109.4° | 109.4° |
| H201 | C20 | H203 | 109.5° | 109.5° |
| H201 | C20 | H202 | 109.5° | 109.5° |
| H203 | C20 | H202 | 109.4° | 109.5° |
| H211 | C21 | H212 | 109.5° | 109.5° |
| H222 | C22 | H221 | 109.4° | 109.5° |
| H232 | C23 | H231 | 109.5° | 109.5° |
| H242 | C24 | H241 | 109.5° | 109.5° |
| H252 | C25 | H251 | 109.5° | 109.5° |
| H61 | C6 | H62 | 109.5° | 109.5° |
| H82 | C8 | H81 | 109.5° | 110.9° |
| H92 | C9 | H91 | 109.5° | 110.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C10 | N2 | C7 | 179.9° | 179.7° |
| O3 | C10 | N2 | C9 | 179.3° | 179.9° |
| O3 | C10 | C7 | C8 | 166.9° | 163.5° |
| O3 | C10 | C7 | C6 | 45.8° | 77.9° |
| O3 | C10 | C7 | H7 | 76.1° | 44.7° |
| O3 | C10 | N2 | HN2 | 0.7° | 0.1° |
| C10 | N2 | C9 | HN2 | 180.0° | 180.0° |
| C10 | N2 | C9 | C8 | 12.1° | 17.1° |
| N2 | C10 | C7 | C8 | 13.2° | 16.2° |
| N2 | C10 | C7 | C6 | 134.3° | 102.4° |
| N2 | C10 | C7 | H7 | 103.9° | 135.0° |
| C10 | N2 | C9 | H92 | 107.2° | 102.0° |
| C10 | N2 | C9 | H91 | 131.3° | 136.0° |
| C7 | C10 | N2 | C9 | 0.8° | 0.4° |
| C10 | C7 | C8 | C9 | 19.4° | 24.8° |
| C10 | C7 | C8 | C6 | 119.6° | 118.7° |
| C10 | C7 | C8 | H7 | 117.3° | 118.8° |
| C10 | C7 | C6 | H7 | 122.1° | 122.6° |
| C10 | C7 | C6 | C4 | 179.7° | 64.9° |
| C10 | C7 | C6 | H61 | 60.3° | 55.1° |
| C10 | C7 | C6 | H62 | 59.8° | 175.1° |
| C10 | C7 | C8 | H82 | 138.7° | 142.9° |
| C10 | C7 | C8 | H81 | 99.8° | 93.3° |
| C7 | C10 | N2 | HN2 | 179.2° | 179.6° |
| N2 | C9 | C8 | H92 | 119.3° | 119.1° |
| N2 | C9 | C8 | H91 | 119.3° | 119.1° |
| N2 | C9 | C8 | C7 | 19.5° | 25.4° |
| N2 | C9 | C8 | H82 | 138.8° | 143.5° |
| N2 | C9 | C8 | H81 | 99.7° | 92.7° |
| N2 | C9 | H92 | H91 | 122.2° | 122.1° |
| C9 | C8 | C7 | H82 | 119.3° | 118.1° |
| C9 | C8 | C7 | H81 | 119.3° | 118.1° |
| C9 | C8 | C7 | C6 | 139.0° | 93.9° |
| C9 | C8 | C7 | H7 | 97.9° | 143.5° |
| C9 | C8 | H82 | H81 | 122.1° | 123.9° |
| C8 | C9 | H92 | H91 | 122.2° | 121.8° |
| C8 | C9 | N2 | HN2 | 168.0° | 163.0° |
| C8 | C7 | C6 | H7 | 123.2° | 122.6° |
| C8 | C7 | C6 | C4 | 65.5° | 179.6° |
| C8 | C7 | C6 | H61 | 54.5° | 59.6° |
| C8 | C7 | C6 | H62 | 174.5° | 60.4° |
| C7 | C8 | H82 | H81 | 122.1° | 123.8° |
| C7 | C8 | C9 | H92 | 99.7° | 93.6° |
| C7 | C8 | C9 | H91 | 138.8° | 144.5° |
| C7 | C6 | C4 | H61 | 120.0° | 120.0° |
| C7 | C6 | C4 | H62 | 120.0° | 120.0° |
| C7 | C6 | C4 | C5 | 175.2° | 77.2° |
| C7 | C6 | C4 | N1 | 64.1° | 162.9° |
| C7 | C6 | C4 | H4 | 55.8° | 42.9° |
| C7 | C6 | H61 | H62 | 120.1° | 120.0° |
| C6 | C7 | C8 | H82 | 101.7° | 24.2° |
| C6 | C7 | C8 | H81 | 19.8° | 148.0° |
| C6 | C4 | C5 | N1 | 122.7° | 120.0° |
| C6 | C4 | C5 | H4 | 119.5° | 120.1° |
| C6 | C4 | N1 | H4 | 119.4° | 120.0° |
| C6 | C4 | C5 | O2 | 66.0° | 56.0° |
| C6 | C4 | C5 | C32 | 173.0° | 64.0° |
| C6 | C4 | N1 | C3 | 119.1° | 87.5° |
| C6 | C4 | C5 | H1 | 55.9° | 176.0° |
| C4 | C6 | H61 | H62 | 120.0° | 120.1° |
| C4 | C6 | C7 | H7 | 57.7° | 57.8° |
| C6 | C4 | N1 | HN1 | 60.9° | 92.4° |
| C5 | C4 | N1 | H4 | 117.3° | 120.0° |
| C4 | C5 | O2 | C32 | 117.9° | 120.0° |
| C4 | C5 | O2 | H1 | 121.3° | 120.0° |
| C4 | C5 | C32 | H1 | 116.9° | 120.0° |
| C5 | C4 | N1 | C3 | 117.6° | 152.5° |
| C4 | C5 | C32 | N33 | 71.3° | 80.0° |
| C4 | C5 | C32 | O36 | 106.1° | 99.8° |
| C5 | C4 | C6 | H61 | 55.2° | 162.8° |
| C5 | C4 | C6 | H62 | 64.8° | 42.8° |
| C5 | C4 | N1 | HN1 | 62.4° | 27.6° |
| C4 | C5 | O2 | HO2 | 180.0° | 60.0° |
| N1 | C4 | C5 | O2 | 171.3° | 64.0° |
| N1 | C4 | C5 | C32 | 50.3° | 176.1° |
| C4 | N1 | C3 | HN1 | 180.0° | 180.0° |
| C4 | N1 | C3 | O1 | 4.5° | 4.0° |
| C4 | N1 | C3 | C2 | 176.0° | 176.0° |
| N1 | C4 | C5 | H1 | 66.8° | 56.0° |
| N1 | C4 | C6 | H61 | 175.9° | 42.9° |
| N1 | C4 | C6 | H62 | 55.9° | 77.2° |
| O2 | C5 | C32 | H1 | 121.4° | 120.0° |
| O2 | C5 | C32 | N33 | 50.5° | 160.0° |
| O2 | C5 | C32 | O36 | 132.2° | 20.2° |
| O2 | C5 | C4 | H4 | 53.4° | 176.1° |
| C5 | C32 | N33 | O36 | 177.6° | 179.8° |
| C5 | C32 | N33 | C34 | 179.2° | 180.0° |
| C5 | C32 | O36 | C35 | 178.9° | 180.0° |
| C32 | C5 | C4 | H4 | 67.5° | 56.1° |
| C32 | C5 | O2 | HO2 | 62.1° | 60.0° |
| N1 | C3 | O1 | C2 | 179.4° | 179.9° |
| N1 | C3 | C2 | C11 | 102.5° | 81.8° |
| N1 | C3 | C2 | N | 136.4° | 158.2° |
| N1 | C3 | C2 | H2 | 15.9° | 38.2° |
| C3 | N1 | C4 | H4 | 0.3° | 32.5° |
| O1 | C3 | C2 | C11 | 78.1° | 98.1° |
| O1 | C3 | C2 | N | 43.0° | 21.9° |
| O1 | C3 | C2 | H2 | 163.6° | 141.8° |
| O1 | C3 | N1 | HN1 | 175.5° | 176.0° |
| C3 | C2 | C11 | N | 121.9° | 120.0° |
| C3 | C2 | C11 | H2 | 118.5° | 120.0° |
| C3 | C2 | N | H2 | 120.2° | 119.9° |
| C3 | C2 | C11 | C12 | 174.6° | 66.3° |
| C3 | C2 | N | C1 | 75.8° | 152.2° |
| C3 | C2 | N | HN | 104.2° | 28.1° |
| C3 | C2 | C11 | H111 | 65.1° | 53.7° |
| C3 | C2 | C11 | H112 | 54.2° | 173.7° |
| C2 | C3 | N1 | HN1 | 4.0° | 4.0° |
| C11 | C2 | N | H2 | 119.0° | 120.0° |
| C2 | C11 | C12 | H111 | 120.3° | 120.0° |
| C2 | C11 | C12 | H112 | 120.4° | 120.1° |
| C2 | C11 | C12 | C21 | 57.3° | 172.9° |
| C2 | C11 | C12 | C25 | 177.8° | 67.1° |
| C11 | C2 | N | C1 | 163.4° | 87.8° |
| C11 | C2 | N | HN | 16.6° | 92.0° |
| C2 | C11 | H111 | H112 | 118.9° | 120.0° |
| C2 | C11 | C12 | H12 | 62.8° | 53.0° |
| N | C2 | C11 | C12 | 63.5° | 173.7° |
| C2 | N | C1 | HN | 180.0° | 179.8° |
| C2 | N | C1 | O | 1.9° | 5.3° |
| C2 | N | C1 | C | 178.3° | 174.8° |
| N | C2 | C11 | H111 | 56.8° | 66.3° |
| N | C2 | C11 | H112 | 176.1° | 53.7° |
| C11 | C12 | C21 | C25 | 120.3° | 120.0° |
| C11 | C12 | C21 | H12 | 120.1° | 120.0° |
| C11 | C12 | C25 | H12 | 119.4° | 120.0° |
| C11 | C12 | C21 | C22 | 178.2° | 180.0° |
| C11 | C12 | C25 | C24 | 177.7° | 180.0° |
| C12 | C11 | H111 | H112 | 119.0° | 120.0° |
| C12 | C11 | C2 | H2 | 56.1° | 53.7° |
| C11 | C12 | C21 | H211 | 58.0° | 60.0° |
| C11 | C12 | C21 | H212 | 61.6° | 60.0° |
| C11 | C12 | C25 | H252 | 57.5° | 60.0° |
| C11 | C12 | C25 | H251 | 62.1° | 60.0° |
| C21 | C12 | C25 | H12 | 119.6° | 119.9° |
| C12 | C21 | C22 | H211 | 120.2° | 119.9° |
| C12 | C21 | C22 | H212 | 120.2° | 120.1° |
| C12 | C21 | C22 | C23 | 53.1° | 59.9° |
| C21 | C12 | C25 | C24 | 61.2° | 60.0° |
| C21 | C12 | C11 | H111 | 177.6° | 52.9° |
| C21 | C12 | C11 | H112 | 63.1° | 67.0° |
| C12 | C21 | H211 | H212 | 119.4° | 120.0° |
| C12 | C21 | C22 | H222 | 173.5° | 180.0° |
| C12 | C21 | C22 | H221 | 67.3° | 60.0° |
| C21 | C12 | C25 | H252 | 178.6° | 180.0° |
| C21 | C12 | C25 | H251 | 58.9° | 60.1° |
| C25 | C12 | C21 | C22 | 57.9° | 59.9° |
| C12 | C25 | C24 | C23 | 58.7° | 60.0° |
| C12 | C25 | C24 | H252 | 120.1° | 120.0° |
| C12 | C25 | C24 | H251 | 120.1° | 120.0° |
| C25 | C12 | C11 | H111 | 61.8° | 173.0° |
| C25 | C12 | C11 | H112 | 57.5° | 53.0° |
| C25 | C12 | C21 | H211 | 62.3° | 60.0° |
| C25 | C12 | C21 | H212 | 178.1° | 180.0° |
| C12 | C25 | C24 | H242 | 178.7° | 180.0° |
| C12 | C25 | C24 | H241 | 61.3° | 60.0° |
| C12 | C25 | H252 | H251 | 119.5° | 120.0° |
| C21 | C22 | C23 | H222 | 120.4° | 120.0° |
| C21 | C22 | C23 | H221 | 120.4° | 120.0° |
| C21 | C22 | C23 | C24 | 51.7° | 60.0° |
| C22 | C21 | C12 | H12 | 61.7° | 60.0° |
| C22 | C21 | H211 | H212 | 119.4° | 120.0° |
| C21 | C22 | H222 | H221 | 118.9° | 120.0° |
| C21 | C22 | C23 | H232 | 68.9° | 60.1° |
| C21 | C22 | C23 | H231 | 172.2° | 180.0° |
| C22 | C23 | C24 | H232 | 120.5° | 120.0° |
| C22 | C23 | C24 | H231 | 120.5° | 120.0° |
| C22 | C23 | C24 | C25 | 54.0° | 60.0° |
| C23 | C22 | C21 | H211 | 67.1° | 60.0° |
| C23 | C22 | C21 | H212 | 173.3° | 180.0° |
| C23 | C22 | H222 | H221 | 118.9° | 120.0° |
| C22 | C23 | H232 | H231 | 118.4° | 119.9° |
| C22 | C23 | C24 | H242 | 174.0° | 180.0° |
| C22 | C23 | C24 | H241 | 66.0° | 60.0° |
| C23 | C24 | C25 | H242 | 120.0° | 120.0° |
| C23 | C24 | C25 | H241 | 120.0° | 120.0° |
| C24 | C23 | C22 | H222 | 172.1° | 180.0° |
| C24 | C23 | C22 | H221 | 68.7° | 60.0° |
| C24 | C23 | H232 | H231 | 118.4° | 120.0° |
| C23 | C24 | H242 | H241 | 119.9° | 120.0° |
| C23 | C24 | C25 | H252 | 178.8° | 180.0° |
| C23 | C24 | C25 | H251 | 61.4° | 60.1° |
| C24 | C25 | C12 | H12 | 58.3° | 60.0° |
| C25 | C24 | C23 | H232 | 66.6° | 60.0° |
| C25 | C24 | C23 | H231 | 174.5° | 179.9° |
| C25 | C24 | H242 | H241 | 119.9° | 120.0° |
| C24 | C25 | H252 | H251 | 119.6° | 119.9° |
| N | C1 | O | C | 179.9° | 180.0° |
| N | C1 | C | C13 | 115.4° | 73.8° |
| N | C1 | C | N3 | 123.0° | 166.2° |
| N | C1 | C | H0 | 2.9° | 46.2° |
| C1 | N | C2 | H2 | 44.4° | 32.2° |
| O | C1 | C | C13 | 64.5° | 106.2° |
| O | C1 | C | N3 | 57.1° | 13.8° |
| O | C1 | N | HN | 178.1° | 174.5° |
| O | C1 | C | H0 | 177.2° | 133.8° |
| C1 | C | C13 | N3 | 120.9° | 120.0° |
| C1 | C | C13 | H0 | 118.6° | 120.0° |
| C1 | C | N3 | H0 | 119.7° | 120.0° |
| C1 | C | C13 | C14 | 41.9° | 62.4° |
| C1 | C | C13 | O4 | 162.5° | 57.6° |
| C1 | C | N3 | C15 | 111.1° | 152.4° |
| C | C1 | N | HN | 1.8° | 5.5° |
| C1 | C | C13 | H13 | 76.7° | 177.6° |
| C1 | C | N3 | HN3 | 68.9° | 27.7° |
| C13 | C | N3 | H0 | 119.8° | 120.0° |
| C | C13 | C14 | O4 | 121.3° | 120.0° |
| C | C13 | C14 | H13 | 118.6° | 120.0° |
| C | C13 | O4 | H13 | 120.0° | 120.0° |
| C | C13 | O4 | C17 | 130.2° | 141.5° |
| C13 | C | N3 | C15 | 128.4° | 87.6° |
| C | C13 | C14 | H142 | 180.0° | 65.7° |
| C | C13 | C14 | H141 | 60.0° | 174.4° |
| C | C13 | C14 | H143 | 60.0° | 54.4° |
| C13 | C | N3 | HN3 | 51.6° | 92.3° |
| N3 | C | C13 | C14 | 162.8° | 57.5° |
| N3 | C | C13 | O4 | 76.5° | 177.5° |
| C | N3 | C15 | HN3 | 180.0° | 179.9° |
| C | N3 | C15 | O6 | 2.3° | 5.1° |
| C | N3 | C15 | O5 | 178.1° | 174.9° |
| N3 | C | C13 | H13 | 44.2° | 62.5° |
| C14 | C13 | O4 | H13 | 119.4° | 120.0° |
| C14 | C13 | O4 | C17 | 109.2° | 98.5° |
| C14 | C13 | C | H0 | 76.7° | 177.6° |
| C13 | C14 | H142 | H141 | 120.0° | 119.9° |
| C13 | C14 | H142 | H143 | 120.0° | 120.0° |
| C13 | C14 | H141 | H143 | 120.0° | 120.0° |
| C13 | O4 | C17 | C18 | 80.9° | 58.2° |
| C13 | O4 | C17 | C19 | 158.9° | 61.8° |
| C13 | O4 | C17 | C20 | 39.5° | 178.2° |
| O4 | C13 | C | H0 | 44.0° | 62.4° |
| O4 | C13 | C14 | H142 | 58.7° | 54.3° |
| O4 | C13 | C14 | H141 | 178.7° | 65.7° |
| O4 | C13 | C14 | H143 | 61.3° | 174.3° |
| O4 | C17 | C18 | C19 | 118.9° | 120.0° |
| O4 | C17 | C18 | C20 | 122.7° | 120.0° |
| O4 | C17 | C19 | C20 | 121.8° | 119.9° |
| C17 | O4 | C13 | H13 | 10.2° | 21.5° |
| O4 | C17 | C18 | H182 | 180.0° | 56.5° |
| O4 | C17 | C18 | H183 | 60.0° | 176.5° |
| O4 | C17 | C18 | H181 | 60.0° | 63.5° |
| O4 | C17 | C19 | H191 | 180.0° | 67.3° |
| O4 | C17 | C19 | H192 | 60.0° | 172.7° |
| O4 | C17 | C19 | H193 | 60.0° | 52.7° |
| O4 | C17 | C20 | H201 | 180.0° | 60.0° |
| O4 | C17 | C20 | H203 | 60.0° | 180.0° |
| O4 | C17 | C20 | H202 | 60.0° | 60.1° |
| C18 | C17 | C19 | C20 | 118.3° | 120.0° |
| C17 | C18 | H182 | H183 | 120.0° | 120.0° |
| C17 | C18 | H182 | H181 | 120.0° | 120.0° |
| C17 | C18 | H183 | H181 | 120.0° | 120.0° |
| C18 | C17 | C19 | H191 | 60.1° | 52.7° |
| C18 | C17 | C19 | H192 | 179.9° | 67.3° |
| C18 | C17 | C19 | H193 | 59.9° | 172.7° |
| C18 | C17 | C20 | H201 | 58.8° | 180.0° |
| C18 | C17 | C20 | H203 | 61.2° | 60.0° |
| C18 | C17 | C20 | H202 | 178.8° | 60.0° |
| C19 | C17 | C18 | H182 | 61.1° | 176.4° |
| C19 | C17 | C18 | H183 | 58.9° | 63.5° |
| C19 | C17 | C18 | H181 | 178.9° | 56.5° |
| C17 | C19 | H191 | H192 | 120.0° | 120.0° |
| C17 | C19 | H191 | H193 | 120.0° | 120.0° |
| C17 | C19 | H192 | H193 | 120.0° | 120.0° |
| C19 | C17 | C20 | H201 | 60.7° | 60.0° |
| C19 | C17 | C20 | H203 | 179.2° | 60.1° |
| C19 | C17 | C20 | H202 | 59.3° | 180.0° |
| C20 | C17 | C18 | H182 | 57.3° | 63.5° |
| C20 | C17 | C18 | H183 | 177.3° | 56.5° |
| C20 | C17 | C18 | H181 | 62.7° | 176.5° |
| C20 | C17 | C19 | H191 | 58.3° | 172.8° |
| C20 | C17 | C19 | H192 | 61.8° | 52.7° |
| C20 | C17 | C19 | H193 | 178.3° | 67.2° |
| C17 | C20 | H201 | H203 | 120.0° | 120.0° |
| C17 | C20 | H201 | H202 | 120.0° | 120.0° |
| C17 | C20 | H203 | H202 | 120.0° | 119.9° |
| N3 | C15 | O6 | O5 | 179.7° | 180.0° |
| N3 | C15 | O5 | C16 | 172.3° | 180.0° |
| C15 | N3 | C | H0 | 8.6° | 32.4° |
| O6 | C15 | O5 | C16 | 8.0° | 0.0° |
| O6 | C15 | N3 | HN3 | 177.7° | 174.9° |
| C15 | O5 | C16 | C26 | 74.2° | 180.0° |
| C15 | O5 | C16 | H162 | 46.3° | 60.0° |
| C15 | O5 | C16 | H161 | 165.5° | 60.0° |
| O5 | C15 | N3 | HN3 | 2.0° | 5.1° |
| O5 | C16 | C26 | H162 | 120.4° | 120.0° |
| O5 | C16 | C26 | H161 | 120.4° | 120.0° |
| O5 | C16 | C26 | C27 | 83.2° | 90.0° |
| O5 | C16 | C26 | C31 | 97.9° | 90.3° |
| O5 | C16 | H162 | H161 | 118.8° | 120.0° |
| C16 | C26 | C27 | C31 | 179.0° | 179.7° |
| C16 | C26 | C27 | C28 | 179.4° | 180.0° |
| C16 | C26 | C31 | C30 | 179.7° | 179.8° |
| C26 | C16 | H162 | H161 | 118.8° | 120.0° |
| C16 | C26 | C27 | H27 | 0.6° | 0.0° |
| C16 | C26 | C31 | H31 | 0.3° | 0.2° |
| C26 | C27 | C28 | H27 | 180.0° | 180.0° |
| C26 | C27 | C28 | C29 | 0.2° | 0.1° |
| C27 | C26 | C31 | C30 | 0.7° | 0.5° |
| C27 | C26 | C16 | H162 | 156.4° | 150.0° |
| C27 | C26 | C16 | H161 | 37.2° | 30.0° |
| C26 | C27 | C28 | H28 | 179.8° | 179.9° |
| C27 | C26 | C31 | H31 | 179.3° | 180.0° |
| C31 | C26 | C27 | C28 | 0.5° | 0.2° |
| C26 | C31 | C30 | C29 | 0.3° | 0.4° |
| C26 | C31 | C30 | H31 | 180.0° | 179.5° |
| C31 | C26 | C16 | H162 | 22.5° | 29.7° |
| C31 | C26 | C16 | H161 | 141.8° | 149.7° |
| C31 | C26 | C27 | H27 | 179.5° | 179.8° |
| C26 | C31 | C30 | H30 | 179.7° | 179.8° |
| C27 | C28 | C29 | H28 | 180.0° | 179.9° |
| C27 | C28 | C29 | C30 | 0.7° | 0.1° |
| C27 | C28 | C29 | H29 | 179.4° | 180.0° |
| C28 | C29 | C30 | H29 | 180.0° | 179.9° |
| C28 | C29 | C30 | C31 | 0.4° | 0.2° |
| C29 | C28 | C27 | H27 | 179.8° | 180.0° |
| C28 | C29 | C30 | H30 | 179.6° | 180.0° |
| C29 | C30 | C31 | H30 | 180.0° | 179.8° |
| C30 | C29 | C28 | H28 | 179.4° | 180.0° |
| C29 | C30 | C31 | H31 | 179.7° | 180.0° |
| C31 | C30 | C29 | H29 | 179.6° | 179.8° |
| C32 | N33 | C34 | C35 | 1.2° | 0.1° |
| C32 | N33 | C34 | C40 | 179.9° | 179.9° |
| N33 | C32 | O36 | C35 | 1.2° | 0.2° |
| N33 | C32 | C5 | H1 | 171.8° | 40.0° |
| O36 | C32 | N33 | C34 | 1.5° | 0.2° |
| C32 | O36 | C35 | C34 | 0.4° | 0.2° |
| C32 | O36 | C35 | C37 | 179.5° | 179.9° |
| O36 | C32 | C5 | H1 | 10.8° | 140.2° |
| N33 | C34 | C35 | C40 | 179.1° | 179.9° |
| N33 | C34 | C35 | O36 | 0.5° | 0.1° |
| N33 | C34 | C35 | C37 | 179.6° | 180.0° |
| N33 | C34 | C40 | C39 | 179.5° | 180.0° |
| N33 | C34 | C40 | H40 | 0.5° | 0.1° |
| C34 | C35 | O36 | C37 | 179.9° | 179.9° |
| C34 | C35 | C37 | C38 | 0.1° | 0.0° |
| C35 | C34 | C40 | C39 | 0.7° | 0.1° |
| C34 | C35 | C37 | H37 | 179.9° | 179.9° |
| C35 | C34 | C40 | H40 | 179.3° | 180.0° |
| C40 | C34 | C35 | O36 | 179.6° | 180.0° |
| C40 | C34 | C35 | C37 | 0.5° | 0.1° |
| C34 | C40 | C39 | C38 | 0.6° | 0.1° |
| C34 | C40 | C39 | H40 | 180.0° | 180.0° |
| C34 | C40 | C39 | H39 | 179.4° | 179.9° |
| O36 | C35 | C37 | C38 | 179.9° | 179.9° |
| O36 | C35 | C37 | H37 | 0.0° | 0.0° |
| C35 | C37 | C38 | H37 | 180.0° | 180.0° |
| C35 | C37 | C38 | C39 | 0.1° | 0.1° |
| C35 | C37 | C38 | H38 | 179.9° | 180.0° |
| C37 | C38 | C39 | H38 | 180.0° | 180.0° |
| C37 | C38 | C39 | C40 | 0.1° | 0.1° |
| C37 | C38 | C39 | H39 | 179.8° | 179.9° |
| C38 | C39 | C40 | H39 | 180.0° | 180.0° |
| C39 | C38 | C37 | H37 | 179.9° | 179.9° |
| C38 | C39 | C40 | H40 | 179.4° | 180.0° |
| C40 | C39 | C38 | H38 | 179.9° | 180.0° |
| HN | N | C2 | H2 | 135.6° | 148.0° |
| H0 | C | C13 | H13 | 164.7° | 57.6° |
| H0 | C | N3 | HN3 | 171.4° | 147.6° |
| H111 | C11 | C12 | H12 | 57.5° | 67.0° |
| H111 | C11 | C2 | H2 | 176.4° | 173.7° |
| H112 | C11 | C12 | H12 | 176.8° | 173.0° |
| H112 | C11 | C2 | H2 | 64.3° | 66.4° |
| H12 | C12 | C21 | H211 | 178.1° | 180.0° |
| H12 | C12 | C21 | H212 | 58.5° | 60.0° |
| H12 | C12 | C25 | H252 | 61.8° | 60.0° |
| H12 | C12 | C25 | H251 | 178.5° | 180.0° |
| H13 | C13 | C14 | H142 | 61.5° | 174.3° |
| H13 | C13 | C14 | H141 | 58.5° | 54.4° |
| H13 | C13 | C14 | H143 | 178.6° | 65.7° |
| H142 | C14 | H141 | H143 | 119.9° | 120.0° |
| H182 | C18 | H183 | H181 | 120.0° | 120.0° |
| H191 | C19 | H192 | H193 | 120.0° | 120.0° |
| H201 | C20 | H203 | H202 | 120.0° | 120.1° |
| H211 | C21 | C22 | H222 | 53.2° | 60.0° |
| H211 | C21 | C22 | H221 | 172.5° | 180.0° |
| H212 | C21 | C22 | H222 | 66.3° | 60.0° |
| H212 | C21 | C22 | H221 | 52.9° | 60.0° |
| H222 | C22 | C23 | H232 | 51.5° | 60.0° |
| H222 | C22 | C23 | H231 | 67.4° | 60.0° |
| H221 | C22 | C23 | H232 | 170.8° | 180.0° |
| H221 | C22 | C23 | H231 | 51.8° | 60.0° |
| H232 | C23 | C24 | H242 | 53.5° | 60.0° |
| H232 | C23 | C24 | H241 | 173.4° | 180.0° |
| H231 | C23 | C24 | H242 | 65.5° | 60.0° |
| H231 | C23 | C24 | H241 | 54.5° | 60.0° |
| H242 | C24 | C25 | H252 | 61.1° | 60.0° |
| H242 | C24 | C25 | H251 | 58.6° | 60.0° |
| H241 | C24 | C25 | H252 | 58.8° | 60.0° |
| H241 | C24 | C25 | H251 | 178.6° | 180.0° |
| H27 | C27 | C28 | H28 | 0.2° | 0.1° |
| H28 | C28 | C29 | H29 | 0.6° | 0.1° |
| H29 | C29 | C30 | H30 | 0.4° | 0.0° |
| H30 | C30 | C31 | H31 | 0.3° | 0.2° |
| H37 | C37 | C38 | H38 | 0.1° | 0.0° |
| H38 | C38 | C39 | H39 | 0.2° | 0.0° |
| H39 | C39 | C40 | H40 | 0.6° | 0.0° |
| H4 | C4 | C5 | H1 | 175.4° | 63.9° |
| H4 | C4 | C6 | H61 | 64.2° | 77.1° |
| H4 | C4 | C6 | H62 | 175.8° | 162.8° |
| H4 | C4 | N1 | HN1 | 179.7° | 147.5° |
| H1 | C5 | O2 | HO2 | 58.7° | 180.0° |
| H61 | C6 | C7 | H7 | 177.6° | 177.8° |
| H62 | C6 | C7 | H7 | 62.3° | 62.2° |
| H7 | C7 | C8 | H82 | 21.4° | 98.4° |
| H7 | C7 | C8 | H81 | 142.9° | 25.4° |
| H82 | C8 | C9 | H92 | 19.5° | 24.5° |
| H82 | C8 | C9 | H91 | 101.9° | 97.4° |
| H81 | C8 | C9 | H92 | 141.0° | 148.2° |
| H81 | C8 | C9 | H91 | 19.5° | 26.4° |
| H92 | C9 | N2 | HN2 | 72.8° | 78.0° |
| H91 | C9 | N2 | HN2 | 48.7° | 44.0° |
