A1IOZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | O01 | doub | 1.22Å | 1.18Å | |
| N03 | C02 | sing | 1.34Å | 1.44Å | |
| O05 | C04 | doub | 1.22Å | 1.19Å | |
| C06 | C04 | sing | 1.41Å | 1.53Å | |
| N07 | C06 | sing | 1.38Å | 1.35Å | Aromatic |
| N09 | C08 | doub | 1.31Å | 1.34Å | Aromatic |
| C10 | N09 | sing | 1.34Å | 1.31Å | Aromatic |
| N11 | C10 | sing | 1.39Å | 1.46Å | |
| C12 | N11 | sing | 1.46Å | 1.45Å | |
| C08 | N07 | sing | 1.35Å | 1.35Å | Aromatic |
| C13 | N07 | sing | 1.46Å | 1.47Å | |
| C14 | C13 | sing | 1.51Å | 1.56Å | |
| O15 | C14 | sing | 1.43Å | 1.40Å | |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| O18 | C17 | sing | 1.43Å | 1.42Å | |
| C19 | C17 | sing | 1.51Å | 1.54Å | |
| N20 | C19 | sing | 1.47Å | 1.46Å | |
| O22 | C21 | doub | 1.22Å | 1.19Å | |
| C23 | C21 | sing | 1.48Å | 1.53Å | |
| C24 | C23 | doub | 1.40Å | 1.39Å | Aromatic |
| C25 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C29 | C25 | sing | 1.51Å | 1.53Å | |
| N30 | C29 | sing | 1.47Å | 1.46Å | |
| C21 | N20 | sing | 1.35Å | 1.45Å | |
| C31 | N20 | sing | 1.41Å | 1.46Å | |
| C16 | C14 | sing | 1.54Å | 1.53Å | |
| C32 | C14 | sing | 1.53Å | 1.54Å | |
| C04 | N03 | sing | 1.35Å | 1.43Å | |
| C33 | N03 | sing | 1.46Å | 1.45Å | |
| C02 | N11 | sing | 1.35Å | 1.45Å | |
| C06 | C10 | doub | 1.39Å | 1.37Å | Aromatic |
| C13 | C31 | sing | 1.55Å | 1.53Å | |
| C23 | C28 | sing | 1.40Å | 1.39Å | Aromatic |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C12 | H123 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C31 | H312 | 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 | |
| C32 | H323 | sing | 1.09Å | 1.10Å | |
| C33 | H333 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| N30 | H301 | sing | 1.01Å | 1.00Å | |
| N30 | H302 | sing | 1.01Å | 1.00Å | |
| O15 | H151 | sing | 0.97Å | 0.95Å | |
| O18 | H181 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C02 | N03 | 121.7° | 119.2° |
| O01 | C02 | N11 | 118.9° | 119.1° |
| C02 | N03 | C04 | 121.2° | 121.0° |
| C02 | N03 | C33 | 119.6° | 119.5° |
| N03 | C02 | N11 | 119.4° | 121.7° |
| O05 | C04 | C06 | 122.0° | 120.4° |
| O05 | C04 | N03 | 118.6° | 120.4° |
| C04 | C06 | N07 | 135.5° | 134.6° |
| C06 | C04 | N03 | 119.3° | 119.2° |
| C04 | C06 | C10 | 117.4° | 119.2° |
| C06 | N07 | C08 | 107.4° | 107.0° |
| C06 | N07 | C13 | 132.1° | 126.5° |
| N07 | C06 | C10 | 107.1° | 106.3° |
| C08 | N09 | C10 | 108.5° | 109.8° |
| N09 | C08 | N07 | 108.3° | 109.7° |
| N09 | C08 | H081 | 125.8° | 125.1° |
| N09 | C10 | N11 | 127.7° | 133.9° |
| N09 | C10 | C06 | 108.6° | 107.2° |
| C10 | N11 | C12 | 117.5° | 119.9° |
| C10 | N11 | C02 | 119.0° | 120.1° |
| N11 | C10 | C06 | 123.7° | 118.9° |
| C12 | N11 | C02 | 123.4° | 120.0° |
| N11 | C12 | H122 | 109.5° | 109.5° |
| N11 | C12 | H123 | 109.5° | 109.5° |
| N11 | C12 | H121 | 109.5° | 109.5° |
| C08 | N07 | C13 | 120.5° | 126.5° |
| N07 | C08 | H081 | 125.8° | 125.2° |
| N07 | C13 | C14 | 111.6° | 109.6° |
| N07 | C13 | C31 | 111.1° | 109.6° |
| N07 | C13 | H131 | 106.3° | 109.6° |
| C13 | C14 | O15 | 109.2° | 108.6° |
| C13 | C14 | C16 | 109.1° | 113.8° |
| C13 | C14 | C32 | 112.8° | 108.6° |
| C14 | C13 | C31 | 116.0° | 108.7° |
| C14 | C13 | H131 | 105.4° | 109.7° |
| O15 | C14 | C16 | 108.6° | 108.6° |
| O15 | C14 | C32 | 107.1° | 108.5° |
| C14 | O15 | H151 | 109.5° | 113.9° |
| C16 | C17 | O18 | 107.0° | 108.9° |
| C16 | C17 | C19 | 115.1° | 112.2° |
| C17 | C16 | C14 | 114.3° | 113.1° |
| C17 | C16 | H162 | 108.3° | 108.8° |
| C17 | C16 | H161 | 108.3° | 108.7° |
| C16 | C17 | H171 | 108.5° | 108.9° |
| O18 | C17 | C19 | 107.7° | 108.9° |
| O18 | C17 | H171 | 110.1° | 108.9° |
| C17 | O18 | H181 | 109.5° | 114.0° |
| C17 | C19 | N20 | 112.7° | 106.6° |
| C19 | C17 | H171 | 108.4° | 109.0° |
| C17 | C19 | H192 | 108.6° | 110.0° |
| C17 | C19 | H191 | 108.7° | 110.0° |
| C19 | N20 | C21 | 115.5° | 118.5° |
| C19 | N20 | C31 | 129.0° | 123.0° |
| N20 | C19 | H192 | 108.6° | 110.0° |
| N20 | C19 | H191 | 108.6° | 110.0° |
| O22 | C21 | C23 | 118.7° | 120.0° |
| O22 | C21 | N20 | 120.1° | 120.0° |
| C21 | C23 | C24 | 118.8° | 120.1° |
| C23 | C21 | N20 | 121.2° | 120.0° |
| C21 | C23 | C28 | 121.4° | 120.1° |
| C23 | C24 | C25 | 119.9° | 119.8° |
| C24 | C23 | C28 | 119.8° | 119.8° |
| C23 | C24 | H241 | 120.1° | 120.2° |
| C24 | C25 | C26 | 120.3° | 120.2° |
| C24 | C25 | C29 | 119.0° | 119.9° |
| C25 | C24 | H241 | 120.0° | 120.0° |
| C26 | C27 | C28 | 119.8° | 120.1° |
| C27 | C26 | C25 | 119.9° | 120.3° |
| C27 | C26 | H261 | 120.1° | 119.9° |
| C26 | C27 | H271 | 120.1° | 119.9° |
| C27 | C28 | C23 | 120.3° | 119.8° |
| C28 | C27 | H271 | 120.1° | 120.0° |
| C27 | C28 | H281 | 119.8° | 120.1° |
| C26 | C25 | C29 | 120.7° | 119.9° |
| C25 | C26 | H261 | 120.1° | 119.8° |
| C25 | C29 | N30 | 110.0° | 109.5° |
| C25 | C29 | H292 | 109.3° | 109.5° |
| C25 | C29 | H291 | 109.3° | 109.5° |
| N30 | C29 | H292 | 109.3° | 109.4° |
| N30 | C29 | H291 | 109.3° | 109.5° |
| C29 | N30 | H301 | 109.5° | 111.0° |
| C29 | N30 | H302 | 109.5° | 111.0° |
| C21 | N20 | C31 | 115.5° | 118.5° |
| N20 | C31 | C13 | 109.9° | 110.2° |
| N20 | C31 | H312 | 109.4° | 109.4° |
| N20 | C31 | H311 | 109.3° | 109.3° |
| C16 | C14 | C32 | 110.0° | 108.6° |
| C14 | C16 | H162 | 108.2° | 108.8° |
| C14 | C16 | H161 | 108.2° | 108.8° |
| C14 | C32 | H322 | 109.5° | 109.5° |
| C14 | C32 | H321 | 109.4° | 109.5° |
| C14 | C32 | H323 | 109.5° | 109.5° |
| C04 | N03 | C33 | 119.3° | 119.5° |
| N03 | C33 | H333 | 109.5° | 109.5° |
| N03 | C33 | H331 | 109.5° | 109.5° |
| N03 | C33 | H332 | 109.5° | 109.5° |
| C31 | C13 | H131 | 105.6° | 109.6° |
| C13 | C31 | H312 | 109.3° | 109.4° |
| C13 | C31 | H311 | 109.3° | 109.3° |
| C23 | C28 | H281 | 119.8° | 120.1° |
| H122 | C12 | H123 | 109.4° | 109.4° |
| H122 | C12 | H121 | 109.5° | 109.4° |
| H123 | C12 | H121 | 109.5° | 109.5° |
| H162 | C16 | H161 | 109.5° | 108.7° |
| H192 | C19 | H191 | 109.5° | 110.1° |
| H312 | C31 | H311 | 109.5° | 109.2° |
| H322 | C32 | H321 | 109.5° | 109.5° |
| H322 | C32 | H323 | 109.4° | 109.5° |
| H321 | C32 | H323 | 109.5° | 109.5° |
| H333 | C33 | H331 | 109.5° | 109.5° |
| H333 | C33 | H332 | 109.4° | 109.5° |
| H331 | C33 | H332 | 109.5° | 109.5° |
| H292 | C29 | H291 | 109.5° | 109.5° |
| H301 | N30 | H302 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C02 | N03 | N11 | 179.1° | 180.0° |
| O01 | C02 | N11 | C10 | 179.3° | 180.0° |
| O01 | C02 | N11 | C12 | 0.7° | 0.0° |
| O01 | C02 | N03 | C04 | 179.4° | 179.5° |
| O01 | C02 | N03 | C33 | 1.0° | 0.1° |
| C02 | N03 | C04 | O05 | 179.6° | 180.0° |
| C02 | N03 | C04 | C06 | 0.0° | 0.6° |
| N03 | C02 | N11 | C10 | 0.1° | 0.0° |
| N03 | C02 | N11 | C12 | 179.9° | 180.0° |
| C02 | N03 | C04 | C33 | 179.6° | 179.4° |
| C02 | N03 | C33 | H333 | 180.0° | 90.5° |
| C02 | N03 | C33 | H331 | 60.0° | 29.5° |
| C02 | N03 | C33 | H332 | 60.0° | 149.5° |
| O05 | C04 | C06 | N03 | 179.6° | 179.4° |
| O05 | C04 | C06 | N07 | 0.2° | 0.4° |
| O05 | C04 | N03 | C33 | 0.8° | 0.6° |
| O05 | C04 | C06 | C10 | 179.2° | 179.6° |
| C04 | C06 | N07 | C10 | 179.0° | 180.0° |
| C04 | C06 | C10 | N09 | 179.2° | 180.0° |
| C04 | C06 | C10 | N11 | 0.5° | 0.2° |
| C04 | C06 | N07 | C08 | 179.1° | 179.9° |
| C04 | C06 | N07 | C13 | 1.1° | 0.1° |
| C06 | C04 | N03 | C33 | 179.6° | 180.0° |
| C06 | N07 | C08 | N09 | 0.1° | 0.0° |
| N07 | C06 | C10 | N09 | 0.0° | 0.0° |
| N07 | C06 | C10 | N11 | 179.8° | 179.8° |
| C06 | N07 | C08 | C13 | 179.8° | 180.0° |
| C06 | N07 | C13 | C14 | 75.2° | 158.3° |
| N07 | C06 | C04 | N03 | 179.3° | 179.8° |
| C06 | N07 | C13 | C31 | 55.9° | 39.1° |
| C06 | N07 | C13 | H131 | 170.4° | 81.2° |
| C06 | N07 | C08 | H081 | 179.9° | 180.0° |
| C08 | N09 | C10 | N11 | 179.8° | 179.7° |
| N09 | C08 | N07 | H081 | 180.0° | 179.9° |
| N09 | C08 | N07 | C13 | 180.0° | 180.0° |
| C08 | N09 | C10 | C06 | 0.1° | 0.0° |
| N09 | C10 | N11 | C06 | 179.7° | 179.7° |
| N09 | C10 | N11 | C12 | 0.6° | 0.0° |
| C10 | N09 | C08 | N07 | 0.1° | 0.0° |
| N09 | C10 | N11 | C02 | 179.4° | 180.0° |
| C10 | N09 | C08 | H081 | 179.9° | 180.0° |
| C10 | N11 | C12 | C02 | 180.0° | 180.0° |
| C10 | N11 | C12 | H122 | 180.0° | 180.0° |
| C10 | N11 | C12 | H123 | 60.0° | 60.0° |
| C10 | N11 | C12 | H121 | 60.0° | 60.0° |
| C12 | N11 | C10 | C06 | 179.7° | 179.7° |
| N11 | C12 | H122 | H123 | 120.0° | 120.0° |
| N11 | C12 | H122 | H121 | 120.0° | 120.0° |
| N11 | C12 | H123 | H121 | 120.0° | 120.0° |
| C08 | N07 | C13 | C14 | 104.6° | 21.7° |
| C08 | N07 | C06 | C10 | 0.0° | 0.0° |
| C08 | N07 | C13 | C31 | 124.3° | 140.9° |
| C08 | N07 | C13 | H131 | 9.8° | 98.9° |
| N07 | C13 | C14 | C31 | 128.6° | 119.8° |
| N07 | C13 | C14 | H131 | 115.0° | 120.4° |
| N07 | C13 | C14 | O15 | 23.6° | 147.8° |
| N07 | C13 | C31 | N20 | 159.3° | 48.2° |
| N07 | C13 | C14 | C16 | 142.2° | 26.7° |
| N07 | C13 | C14 | C32 | 95.3° | 94.4° |
| C13 | N07 | C06 | C10 | 179.9° | 180.0° |
| N07 | C13 | C31 | H131 | 114.9° | 120.3° |
| N07 | C13 | C31 | H312 | 80.7° | 168.5° |
| N07 | C13 | C31 | H311 | 39.2° | 71.9° |
| C13 | N07 | C08 | H081 | 0.1° | 0.0° |
| C13 | C14 | O15 | C16 | 118.8° | 124.2° |
| C13 | C14 | O15 | C32 | 122.4° | 117.8° |
| C13 | C14 | C16 | C17 | 65.1° | 42.9° |
| C14 | C13 | C31 | N20 | 71.9° | 71.5° |
| C13 | C14 | C16 | C32 | 124.2° | 121.1° |
| C14 | C13 | C31 | H131 | 116.3° | 119.9° |
| C13 | C14 | C16 | H162 | 55.6° | 163.9° |
| C13 | C14 | C16 | H161 | 174.2° | 77.9° |
| C14 | C13 | C31 | H312 | 48.1° | 48.7° |
| C14 | C13 | C31 | H311 | 168.0° | 168.3° |
| C13 | C14 | C32 | H322 | 180.0° | 64.2° |
| C13 | C14 | C32 | H321 | 60.0° | 55.8° |
| C13 | C14 | C32 | H323 | 60.0° | 175.8° |
| C13 | C14 | O15 | H151 | 180.0° | 175.7° |
| O15 | C14 | C16 | C17 | 175.9° | 78.2° |
| O15 | C14 | C16 | C32 | 116.9° | 117.8° |
| O15 | C14 | C13 | C31 | 152.2° | 28.1° |
| O15 | C14 | C13 | H131 | 91.4° | 91.7° |
| O15 | C14 | C16 | H162 | 63.3° | 42.8° |
| O15 | C14 | C16 | H161 | 55.2° | 161.0° |
| O15 | C14 | C32 | H322 | 59.8° | 177.9° |
| O15 | C14 | C32 | H321 | 179.9° | 62.1° |
| O15 | C14 | C32 | H323 | 60.1° | 57.9° |
| C16 | C17 | O18 | C19 | 124.3° | 122.6° |
| C16 | C17 | O18 | H171 | 117.7° | 118.7° |
| C16 | C17 | C19 | H171 | 121.7° | 120.7° |
| C16 | C17 | C19 | N20 | 77.7° | 90.0° |
| C17 | C16 | C14 | H162 | 120.7° | 120.9° |
| C17 | C16 | C14 | H161 | 120.7° | 120.8° |
| C17 | C16 | C14 | C32 | 59.0° | 164.0° |
| C17 | C16 | H162 | H161 | 117.8° | 118.2° |
| C16 | C17 | C19 | H192 | 161.8° | 150.7° |
| C16 | C17 | C19 | H191 | 42.7° | 29.3° |
| C16 | C17 | O18 | H181 | 180.0° | 175.0° |
| O18 | C17 | C19 | H171 | 119.1° | 118.7° |
| O18 | C17 | C19 | N20 | 163.0° | 149.4° |
| O18 | C17 | C16 | C14 | 174.1° | 162.6° |
| O18 | C17 | C16 | H162 | 65.2° | 41.6° |
| O18 | C17 | C16 | H161 | 53.4° | 76.6° |
| O18 | C17 | C19 | H192 | 42.6° | 30.1° |
| O18 | C17 | C19 | H191 | 76.5° | 91.4° |
| C17 | C19 | N20 | H192 | 120.5° | 119.3° |
| C17 | C19 | N20 | H191 | 120.5° | 119.3° |
| C17 | C19 | N20 | C21 | 117.6° | 100.9° |
| C17 | C19 | N20 | C31 | 61.3° | 79.1° |
| C19 | C17 | C16 | C14 | 66.3° | 42.0° |
| C19 | C17 | C16 | H162 | 54.4° | 79.0° |
| C19 | C17 | C16 | H161 | 173.0° | 162.8° |
| C17 | C19 | H192 | H191 | 118.5° | 121.4° |
| C19 | C17 | O18 | H181 | 55.7° | 62.3° |
| C19 | N20 | C21 | O22 | 0.5° | 175.5° |
| C19 | N20 | C21 | C23 | 179.7° | 4.5° |
| C19 | N20 | C21 | C31 | 179.0° | 180.0° |
| C19 | N20 | C31 | C13 | 1.9° | 59.1° |
| N20 | C19 | C17 | H171 | 44.0° | 30.7° |
| N20 | C19 | H192 | H191 | 118.5° | 121.4° |
| C19 | N20 | C31 | H312 | 118.1° | 61.2° |
| C19 | N20 | C31 | H311 | 122.0° | 179.3° |
| O22 | C21 | C23 | N20 | 179.2° | 180.0° |
| O22 | C21 | C23 | C24 | 73.7° | 46.0° |
| O22 | C21 | N20 | C31 | 179.5° | 4.6° |
| O22 | C21 | C23 | C28 | 105.6° | 133.7° |
| C21 | C23 | C24 | C28 | 179.4° | 179.7° |
| C21 | C23 | C24 | C25 | 179.5° | 179.8° |
| C21 | C23 | C28 | C27 | 179.9° | 179.8° |
| C23 | C21 | N20 | C31 | 1.2° | 175.4° |
| C21 | C23 | C24 | H241 | 0.5° | 0.0° |
| C21 | C23 | C28 | H281 | 0.2° | 0.2° |
| C23 | C24 | C25 | H241 | 180.0° | 179.8° |
| C24 | C23 | C28 | C27 | 0.5° | 0.0° |
| C23 | C24 | C25 | C26 | 0.2° | 0.0° |
| C23 | C24 | C25 | C29 | 179.9° | 180.0° |
| C24 | C23 | C21 | N20 | 105.5° | 134.0° |
| C24 | C23 | C28 | H281 | 179.5° | 180.0° |
| C24 | C25 | C26 | C27 | 0.0° | 0.0° |
| C24 | C25 | C26 | C29 | 179.9° | 180.0° |
| C24 | C25 | C29 | N30 | 15.7° | 90.0° |
| C25 | C24 | C23 | C28 | 0.1° | 0.0° |
| C24 | C25 | C26 | H261 | 180.0° | 180.0° |
| C24 | C25 | C29 | H292 | 104.4° | 150.0° |
| C24 | C25 | C29 | H291 | 135.8° | 30.0° |
| C26 | C27 | C28 | H271 | 180.0° | 180.0° |
| C27 | C26 | C25 | H261 | 180.0° | 180.0° |
| C27 | C26 | C25 | C29 | 180.0° | 180.0° |
| C26 | C27 | C28 | C23 | 0.7° | 0.0° |
| C26 | C27 | C28 | H281 | 179.4° | 180.0° |
| C28 | C27 | C26 | C25 | 0.4° | 0.0° |
| C27 | C28 | C23 | H281 | 180.0° | 180.0° |
| C28 | C27 | C26 | H261 | 179.6° | 180.0° |
| C26 | C25 | C29 | N30 | 164.4° | 90.0° |
| C26 | C25 | C24 | H241 | 179.8° | 179.8° |
| C25 | C26 | C27 | H271 | 179.6° | 180.0° |
| C26 | C25 | C29 | H292 | 75.6° | 29.9° |
| C26 | C25 | C29 | H291 | 44.3° | 150.0° |
| C25 | C29 | N30 | H292 | 120.1° | 120.0° |
| C25 | C29 | N30 | H291 | 120.1° | 120.0° |
| C29 | C25 | C24 | H241 | 0.1° | 0.3° |
| C29 | C25 | C26 | H261 | 0.0° | 0.0° |
| C25 | C29 | H292 | H291 | 119.7° | 120.0° |
| C25 | C29 | N30 | H301 | 180.0° | 180.0° |
| C25 | C29 | N30 | H302 | 60.0° | 56.1° |
| N30 | C29 | H292 | H291 | 119.8° | 120.0° |
| C29 | N30 | H301 | H302 | 120.0° | 123.9° |
| C21 | N20 | C31 | C13 | 179.2° | 120.8° |
| N20 | C21 | C23 | C28 | 75.1° | 46.3° |
| C21 | N20 | C19 | H192 | 2.8° | 18.4° |
| C21 | N20 | C19 | H191 | 121.9° | 139.8° |
| C21 | N20 | C31 | H312 | 60.8° | 118.9° |
| C21 | N20 | C31 | H311 | 59.2° | 0.7° |
| N20 | C31 | C13 | H312 | 120.1° | 120.3° |
| N20 | C31 | C13 | H311 | 120.0° | 120.2° |
| N20 | C31 | C13 | H131 | 44.4° | 168.6° |
| C31 | N20 | C19 | H192 | 178.3° | 161.7° |
| C31 | N20 | C19 | H191 | 59.2° | 40.2° |
| N20 | C31 | H312 | H311 | 119.8° | 119.6° |
| C16 | C14 | C13 | C31 | 89.2° | 93.0° |
| C16 | C14 | C13 | H131 | 27.2° | 147.2° |
| C14 | C16 | H162 | H161 | 117.8° | 118.3° |
| C14 | C16 | C17 | H171 | 55.4° | 78.8° |
| C16 | C14 | C32 | H322 | 58.0° | 60.0° |
| C16 | C14 | C32 | H321 | 62.0° | 180.0° |
| C16 | C14 | C32 | H323 | 178.0° | 60.0° |
| C16 | C14 | O15 | H151 | 61.1° | 60.0° |
| C32 | C14 | C13 | C31 | 33.3° | 145.8° |
| C32 | C14 | C13 | H131 | 149.7° | 26.0° |
| C32 | C14 | C16 | H162 | 179.7° | 75.1° |
| C32 | C14 | C16 | H161 | 61.7° | 43.2° |
| C14 | C32 | H322 | H321 | 120.0° | 120.0° |
| C14 | C32 | H322 | H323 | 120.0° | 120.0° |
| C14 | C32 | H321 | H323 | 120.0° | 120.0° |
| C32 | C14 | O15 | H151 | 57.6° | 57.9° |
| C04 | N03 | C02 | N11 | 0.3° | 0.5° |
| N03 | C04 | C06 | C10 | 0.4° | 0.2° |
| C04 | N03 | C33 | H333 | 0.4° | 90.0° |
| C04 | N03 | C33 | H331 | 120.4° | 150.0° |
| C04 | N03 | C33 | H332 | 119.6° | 29.9° |
| C33 | N03 | C02 | N11 | 179.9° | 179.9° |
| N03 | C33 | H333 | H331 | 120.0° | 120.0° |
| N03 | C33 | H333 | H332 | 120.0° | 120.0° |
| N03 | C33 | H331 | H332 | 120.0° | 120.0° |
| C02 | N11 | C10 | C06 | 0.3° | 0.3° |
| C02 | N11 | C12 | H122 | 0.1° | 0.0° |
| C02 | N11 | C12 | H123 | 120.0° | 120.0° |
| C02 | N11 | C12 | H121 | 119.9° | 120.0° |
| C13 | C31 | H312 | H311 | 119.8° | 119.6° |
| C28 | C23 | C24 | H241 | 179.9° | 179.7° |
| C23 | C28 | C27 | H271 | 179.3° | 180.0° |
| H122 | C12 | H123 | H121 | 120.0° | 119.9° |
| H131 | C13 | C31 | H312 | 164.4° | 71.2° |
| H131 | C13 | C31 | H311 | 75.7° | 48.4° |
| H162 | C16 | C17 | H171 | 176.1° | 160.3° |
| H161 | C16 | C17 | H171 | 65.3° | 42.1° |
| H171 | C17 | C19 | H192 | 76.5° | 88.5° |
| H171 | C17 | C19 | H191 | 164.4° | 150.0° |
| H171 | C17 | O18 | H181 | 62.4° | 56.4° |
| H261 | C26 | C27 | H271 | 0.4° | 0.0° |
| H271 | C27 | C28 | H281 | 0.7° | 0.0° |
| H322 | C32 | H321 | H323 | 120.0° | 120.0° |
| H333 | C33 | H331 | H332 | 120.0° | 120.0° |
| H292 | C29 | N30 | H301 | 59.9° | 60.1° |
| H292 | C29 | N30 | H302 | 180.0° | 176.0° |
| H291 | C29 | N30 | H301 | 60.0° | 60.0° |
| H291 | C29 | N30 | H302 | 60.1° | 63.9° |
