LLL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C11 | O11 | sing | 1.43Å | 1.45Å | |
| C11 | C21 | sing | 1.53Å | 1.53Å | |
| C11 | O51 | sing | 1.43Å | 1.49Å | |
| C11 | H11 | sing | 1.09Å | 1.11Å | |
| O11 | C42 | sing | 1.43Å | 1.39Å | |
| C21 | N21 | sing | 1.47Å | 1.43Å | |
| C21 | C31 | sing | 1.53Å | 1.57Å | |
| C21 | H21 | sing | 1.09Å | 1.12Å | |
| N21 | H211 | sing | 1.01Å | 1.02Å | |
| N21 | H212 | sing | 1.01Å | 1.02Å | |
| C31 | C41 | sing | 1.53Å | 1.56Å | |
| C31 | H311 | sing | 1.09Å | 1.11Å | |
| C31 | H312 | sing | 1.09Å | 1.11Å | |
| C41 | C51 | sing | 1.53Å | 1.59Å | |
| C41 | H411 | sing | 1.09Å | 1.11Å | |
| C41 | H412 | sing | 1.09Å | 1.12Å | |
| C51 | O51 | sing | 1.43Å | 1.46Å | |
| C51 | C61 | sing | 1.53Å | 1.51Å | |
| C51 | H51 | sing | 1.09Å | 1.11Å | |
| C61 | N61 | sing | 1.47Å | 1.44Å | |
| C61 | H611 | sing | 1.09Å | 1.11Å | |
| C61 | H612 | sing | 1.09Å | 1.11Å | |
| N61 | H11A | sing | 1.01Å | 1.02Å | |
| N61 | H12A | sing | 1.01Å | 1.02Å | |
| C12 | N12 | sing | 1.47Å | 1.43Å | |
| C12 | C22 | sing | 1.53Å | 1.56Å | |
| C12 | C62 | sing | 1.53Å | 1.54Å | |
| C12 | H12 | sing | 1.09Å | 1.12Å | |
| N12 | H121 | sing | 1.01Å | 1.02Å | |
| N12 | H122 | sing | 1.01Å | 1.02Å | |
| C22 | C32 | sing | 1.53Å | 1.57Å | |
| C22 | H221 | sing | 1.09Å | 1.12Å | |
| C22 | H222 | sing | 1.09Å | 1.12Å | |
| C32 | N32 | sing | 1.47Å | 1.47Å | |
| C32 | C42 | sing | 1.53Å | 1.58Å | |
| C32 | H32 | sing | 1.09Å | 1.11Å | |
| N32 | H321 | sing | 1.01Å | 1.02Å | |
| N32 | H322 | sing | 1.01Å | 1.02Å | |
| C42 | C52 | sing | 1.53Å | 1.58Å | |
| C42 | H42 | sing | 1.09Å | 1.12Å | |
| C52 | O52 | sing | 1.43Å | 1.42Å | |
| C52 | C62 | sing | 1.53Å | 1.57Å | |
| C52 | H52 | sing | 1.09Å | 1.11Å | |
| O52 | H3 | sing | 0.97Å | 0.95Å | |
| C62 | O62 | sing | 1.43Å | 1.42Å | |
| C62 | H62 | sing | 1.09Å | 1.12Å | |
| O62 | C13 | sing | 1.43Å | 1.46Å | |
| C13 | C23 | sing | 1.53Å | 1.54Å | |
| C13 | O53 | sing | 1.43Å | 1.49Å | |
| C13 | H13 | sing | 1.09Å | 1.12Å | |
| C23 | O23 | sing | 1.43Å | 1.41Å | |
| C23 | C33 | sing | 1.53Å | 1.58Å | |
| C23 | H23 | sing | 1.09Å | 1.11Å | |
| O23 | H2 | sing | 0.97Å | 0.95Å | |
| C33 | N33 | sing | 1.47Å | 1.50Å | |
| C33 | C43 | sing | 1.53Å | 1.62Å | |
| C33 | H1 | sing | 1.09Å | 1.11Å | |
| N33 | C93 | sing | 1.47Å | 1.47Å | |
| N33 | H33 | sing | 1.01Å | 1.02Å | |
| C43 | O43 | sing | 1.43Å | 1.41Å | |
| C43 | C53 | sing | 1.53Å | 1.56Å | |
| C43 | C83 | sing | 1.53Å | 1.53Å | |
| O43 | H43 | sing | 0.97Å | 0.95Å | |
| C53 | O53 | sing | 1.43Å | 1.50Å | |
| C53 | H531 | sing | 1.09Å | 1.12Å | |
| C53 | H532 | sing | 1.09Å | 1.12Å | |
| C83 | H831 | sing | 1.09Å | 1.11Å | |
| C83 | H832 | sing | 1.09Å | 1.12Å | |
| C83 | H833 | sing | 1.09Å | 1.11Å | |
| C93 | H931 | sing | 1.09Å | 1.11Å | |
| C93 | H932 | sing | 1.09Å | 1.11Å | |
| C93 | H933 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O11 | C11 | C21 | 109.8° | 109.4° |
| O11 | C11 | O51 | 109.9° | 109.4° |
| O11 | C11 | H11 | 109.9° | 109.4° |
| C11 | O11 | C42 | 118.6° | 106.8° |
| C21 | C11 | O51 | 111.9° | 109.8° |
| C21 | C11 | H11 | 107.7° | 109.5° |
| C11 | C21 | N21 | 108.6° | 109.5° |
| C11 | C21 | C31 | 110.4° | 109.1° |
| C11 | C21 | H21 | 110.3° | 109.6° |
| O51 | C11 | H11 | 107.6° | 109.4° |
| C11 | O51 | C51 | 115.1° | 107.6° |
| O11 | C42 | C32 | 109.8° | 109.5° |
| O11 | C42 | C52 | 111.2° | 109.5° |
| O11 | C42 | H42 | 108.1° | 109.4° |
| N21 | C21 | C31 | 111.9° | 109.6° |
| N21 | C21 | H21 | 108.8° | 109.5° |
| C21 | N21 | H211 | 112.5° | 106.7° |
| C21 | N21 | H212 | 108.6° | 106.7° |
| C31 | C21 | H21 | 106.9° | 109.5° |
| C21 | C31 | C41 | 108.0° | 108.7° |
| C21 | C31 | H311 | 112.8° | 109.6° |
| C21 | C31 | H312 | 112.7° | 109.6° |
| H211 | N21 | H212 | 112.5° | 106.6° |
| C41 | C31 | H311 | 112.7° | 109.6° |
| C41 | C31 | H312 | 112.8° | 109.6° |
| C31 | C41 | C51 | 108.6° | 109.0° |
| C31 | C41 | H411 | 112.5° | 109.5° |
| C31 | C41 | H412 | 112.5° | 109.6° |
| H311 | C31 | H312 | 97.7° | 109.7° |
| C51 | C41 | H411 | 112.5° | 109.5° |
| C51 | C41 | H412 | 112.6° | 109.6° |
| C41 | C51 | O51 | 112.3° | 109.8° |
| C41 | C51 | C61 | 114.1° | 109.4° |
| C41 | C51 | H51 | 104.1° | 109.4° |
| H411 | C41 | H412 | 97.9° | 109.6° |
| O51 | C51 | C61 | 109.6° | 109.4° |
| O51 | C51 | H51 | 109.2° | 109.5° |
| C61 | C51 | H51 | 107.1° | 109.4° |
| C51 | C61 | N61 | 111.8° | 109.5° |
| C51 | C61 | H611 | 111.4° | 109.5° |
| C51 | C61 | H612 | 111.3° | 109.5° |
| N61 | C61 | H611 | 111.3° | 109.5° |
| N61 | C61 | H612 | 111.3° | 109.5° |
| C61 | N61 | H11A | 111.4° | 106.7° |
| C61 | N61 | H12A | 111.8° | 106.7° |
| H611 | C61 | H612 | 99.0° | 109.5° |
| H11A | N61 | H12A | 111.4° | 106.7° |
| N12 | C12 | C22 | 109.5° | 109.5° |
| N12 | C12 | C62 | 109.2° | 109.4° |
| N12 | C12 | H12 | 110.2° | 109.5° |
| C12 | N12 | H121 | 112.2° | 106.7° |
| C12 | N12 | H122 | 109.5° | 106.7° |
| C22 | C12 | C62 | 111.0° | 109.5° |
| C22 | C12 | H12 | 108.3° | 109.5° |
| C12 | C22 | C32 | 109.9° | 109.5° |
| C12 | C22 | H221 | 112.1° | 109.5° |
| C12 | C22 | H222 | 112.1° | 109.5° |
| C62 | C12 | H12 | 108.6° | 109.5° |
| C12 | C62 | C52 | 109.7° | 109.4° |
| C12 | C62 | O62 | 110.0° | 109.5° |
| C12 | C62 | H62 | 108.8° | 109.5° |
| H121 | N12 | H122 | 112.2° | 106.7° |
| C32 | C22 | H221 | 112.1° | 109.4° |
| C32 | C22 | H222 | 112.1° | 109.5° |
| C22 | C32 | N32 | 110.1° | 109.5° |
| C22 | C32 | C42 | 109.5° | 109.5° |
| C22 | C32 | H32 | 109.4° | 109.5° |
| H221 | C22 | H222 | 98.3° | 109.5° |
| N32 | C32 | C42 | 110.7° | 109.5° |
| N32 | C32 | H32 | 108.3° | 109.4° |
| C32 | N32 | H321 | 112.0° | 106.7° |
| C32 | N32 | H322 | 110.1° | 106.7° |
| C42 | C32 | H32 | 108.8° | 109.5° |
| C32 | C42 | C52 | 109.6° | 109.5° |
| C32 | C42 | H42 | 109.8° | 109.4° |
| H321 | N32 | H322 | 112.0° | 106.7° |
| C52 | C42 | H42 | 108.3° | 109.5° |
| C42 | C52 | O52 | 110.5° | 109.5° |
| C42 | C52 | C62 | 109.8° | 109.5° |
| C42 | C52 | H52 | 108.6° | 109.4° |
| O52 | C52 | C62 | 109.6° | 109.5° |
| O52 | C52 | H52 | 108.8° | 109.5° |
| C52 | O52 | H3 | 110.5° | 106.8° |
| C62 | C52 | H52 | 109.5° | 109.5° |
| C52 | C62 | O62 | 109.0° | 109.4° |
| C52 | C62 | H62 | 109.8° | 109.4° |
| O62 | C62 | H62 | 109.5° | 109.5° |
| C62 | O62 | C13 | 123.1° | 106.8° |
| O62 | C13 | C23 | 105.9° | 109.4° |
| O62 | C13 | O53 | 111.6° | 109.4° |
| O62 | C13 | H13 | 110.6° | 109.4° |
| C23 | C13 | O53 | 109.9° | 109.8° |
| C23 | C13 | H13 | 112.2° | 109.4° |
| C13 | C23 | O23 | 108.9° | 109.6° |
| C13 | C23 | C33 | 108.0° | 109.0° |
| C13 | C23 | H23 | 111.7° | 109.5° |
| O53 | C13 | H13 | 106.7° | 109.4° |
| C13 | O53 | C53 | 116.5° | 107.6° |
| O23 | C23 | C33 | 111.8° | 109.6° |
| O23 | C23 | H23 | 107.8° | 109.5° |
| C23 | O23 | H2 | 108.9° | 106.8° |
| C33 | C23 | H23 | 108.7° | 109.5° |
| C23 | C33 | N33 | 111.5° | 109.6° |
| C23 | C33 | C43 | 110.2° | 108.8° |
| C23 | C33 | H1 | 107.8° | 109.6° |
| N33 | C33 | C43 | 110.0° | 109.6° |
| N33 | C33 | H1 | 108.0° | 109.6° |
| C33 | N33 | C93 | 117.1° | 106.7° |
| C33 | N33 | H33 | 109.4° | 106.7° |
| C43 | C33 | H1 | 109.3° | 109.6° |
| C33 | C43 | O43 | 111.3° | 109.3° |
| C33 | C43 | C53 | 109.1° | 109.0° |
| C33 | C43 | C83 | 116.8° | 109.8° |
| C93 | N33 | H33 | 109.4° | 106.7° |
| N33 | C93 | H931 | 109.4° | 109.5° |
| N33 | C93 | H932 | 117.1° | 109.5° |
| N33 | C93 | H933 | 109.4° | 109.5° |
| O43 | C43 | C53 | 107.7° | 109.5° |
| O43 | C43 | C83 | 103.3° | 109.6° |
| C43 | O43 | H43 | 111.3° | 106.8° |
| C53 | C43 | C83 | 108.2° | 109.6° |
| C43 | C53 | O53 | 110.6° | 110.0° |
| C43 | C53 | H531 | 111.8° | 109.4° |
| C43 | C53 | H532 | 111.8° | 109.3° |
| C43 | C83 | H831 | 109.6° | 109.4° |
| C43 | C83 | H832 | 116.8° | 109.5° |
| C43 | C83 | H833 | 109.5° | 109.4° |
| O53 | C53 | H531 | 111.8° | 109.5° |
| O53 | C53 | H532 | 111.8° | 109.4° |
| H531 | C53 | H532 | 98.6° | 109.3° |
| H831 | C83 | H832 | 109.6° | 109.6° |
| H831 | C83 | H833 | 100.6° | 109.5° |
| H832 | C83 | H833 | 109.6° | 109.4° |
| H931 | C93 | H932 | 109.5° | 109.5° |
| H931 | C93 | H933 | 100.7° | 109.5° |
| H932 | C93 | H933 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O11 | C11 | C21 | O51 | 122.3° | 120.1° |
| O11 | C11 | C21 | H11 | 119.6° | 119.8° |
| O11 | C11 | O51 | H11 | 119.6° | 119.8° |
| O11 | C11 | C21 | N21 | 56.3° | 61.1° |
| O11 | C11 | C21 | C31 | 66.6° | 58.8° |
| O11 | C11 | C21 | H21 | 175.5° | 178.7° |
| O11 | C11 | O51 | C51 | 69.9° | 52.5° |
| C11 | O11 | C42 | C32 | 141.6° | 148.5° |
| C11 | O11 | C42 | C52 | 97.0° | 91.4° |
| C11 | O11 | C42 | H42 | 21.8° | 28.6° |
| C21 | C11 | O51 | H11 | 118.1° | 120.1° |
| C21 | C11 | O11 | C42 | 146.6° | 165.3° |
| C11 | C21 | N21 | C31 | 122.1° | 119.6° |
| C11 | C21 | N21 | H21 | 120.1° | 120.2° |
| C11 | C21 | C31 | H21 | 120.0° | 119.9° |
| C11 | C21 | N21 | H211 | 54.7° | 179.6° |
| C11 | C21 | N21 | H212 | 180.0° | 65.9° |
| C11 | C21 | C31 | C41 | 60.1° | 53.8° |
| C11 | C21 | C31 | H311 | 174.7° | 173.5° |
| C11 | C21 | C31 | H312 | 65.2° | 66.0° |
| C21 | C11 | O51 | C51 | 52.3° | 67.6° |
| O51 | C11 | O11 | C42 | 89.9° | 74.4° |
| O51 | C11 | C21 | N21 | 178.7° | 178.8° |
| O51 | C11 | C21 | C31 | 55.7° | 61.3° |
| O51 | C11 | C21 | H21 | 62.2° | 58.6° |
| C11 | O51 | C51 | C41 | 52.1° | 67.6° |
| C11 | O51 | C51 | C61 | 180.0° | 172.4° |
| C11 | O51 | C51 | H51 | 62.9° | 52.5° |
| H11 | C11 | O11 | C42 | 28.3° | 45.4° |
| H11 | C11 | C21 | N21 | 63.3° | 58.7° |
| H11 | C11 | C21 | C31 | 173.7° | 178.6° |
| H11 | C11 | C21 | H21 | 55.9° | 61.5° |
| H11 | C11 | O51 | C51 | 170.5° | 172.3° |
| O11 | C42 | C32 | C22 | 179.0° | 180.0° |
| O11 | C42 | C32 | N32 | 57.5° | 59.9° |
| O11 | C42 | C32 | C52 | 122.4° | 120.1° |
| O11 | C42 | C32 | H42 | 118.8° | 119.9° |
| O11 | C42 | C32 | H32 | 61.4° | 60.0° |
| O11 | C42 | C52 | H42 | 118.7° | 120.0° |
| O11 | C42 | C52 | O52 | 58.3° | 60.0° |
| O11 | C42 | C52 | C62 | 179.4° | 180.0° |
| O11 | C42 | C52 | H52 | 60.9° | 60.0° |
| N21 | C21 | C31 | H21 | 119.0° | 120.2° |
| C21 | N21 | H211 | H212 | 123.1° | 113.7° |
| N21 | C21 | C31 | C41 | 178.8° | 173.7° |
| N21 | C21 | C31 | H311 | 53.6° | 66.6° |
| N21 | C21 | C31 | H312 | 55.9° | 53.9° |
| C31 | C21 | N21 | H211 | 176.9° | 60.0° |
| C31 | C21 | N21 | H212 | 57.9° | 53.7° |
| C21 | C31 | C41 | H311 | 125.3° | 119.8° |
| C21 | C31 | C41 | H312 | 125.3° | 119.8° |
| C21 | C31 | H311 | H312 | 118.6° | 120.4° |
| C21 | C31 | C41 | C51 | 58.5° | 53.7° |
| C21 | C31 | C41 | H411 | 66.8° | 66.2° |
| C21 | C31 | C41 | H412 | 176.2° | 173.6° |
| H21 | C21 | N21 | H211 | 65.3° | 60.2° |
| H21 | C21 | N21 | H212 | 59.9° | 173.9° |
| H21 | C21 | C31 | C41 | 59.9° | 66.2° |
| H21 | C21 | C31 | H311 | 65.4° | 53.6° |
| H21 | C21 | C31 | H312 | 174.8° | 174.1° |
| C41 | C31 | H311 | H312 | 118.7° | 120.4° |
| C31 | C41 | C51 | H411 | 125.3° | 119.8° |
| C31 | C41 | C51 | H412 | 125.3° | 119.9° |
| C31 | C41 | H411 | H412 | 118.5° | 120.3° |
| C31 | C41 | C51 | O51 | 55.2° | 61.2° |
| C31 | C41 | C51 | C61 | 179.3° | 178.7° |
| C31 | C41 | C51 | H51 | 62.8° | 58.9° |
| H311 | C31 | C41 | C51 | 176.2° | 173.5° |
| H311 | C31 | C41 | H411 | 58.5° | 53.6° |
| H311 | C31 | C41 | H412 | 51.0° | 66.7° |
| H312 | C31 | C41 | C51 | 66.8° | 66.1° |
| H312 | C31 | C41 | H411 | 168.0° | 174.1° |
| H312 | C31 | C41 | H412 | 58.5° | 53.8° |
| C51 | C41 | H411 | H412 | 118.5° | 120.2° |
| C41 | C51 | O51 | C61 | 128.0° | 120.0° |
| C41 | C51 | O51 | H51 | 115.0° | 120.0° |
| C41 | C51 | C61 | H51 | 114.7° | 119.8° |
| C41 | C51 | C61 | N61 | 124.9° | 174.7° |
| C41 | C51 | C61 | H611 | 0.4° | 54.7° |
| C41 | C51 | C61 | H612 | 109.9° | 65.3° |
| H411 | C41 | C51 | O51 | 70.1° | 58.6° |
| H411 | C41 | C51 | C61 | 55.5° | 61.5° |
| H411 | C41 | C51 | H51 | 171.9° | 178.7° |
| H412 | C41 | C51 | O51 | 179.5° | 178.9° |
| H412 | C41 | C51 | C61 | 54.0° | 58.8° |
| H412 | C41 | C51 | H51 | 62.5° | 61.0° |
| O51 | C51 | C61 | H51 | 118.4° | 119.9° |
| O51 | C51 | C61 | N61 | 2.1° | 65.0° |
| O51 | C51 | C61 | H611 | 127.3° | 175.0° |
| O51 | C51 | C61 | H612 | 123.2° | 55.0° |
| C51 | C61 | N61 | H611 | 125.3° | 120.0° |
| C51 | C61 | N61 | H612 | 125.3° | 120.0° |
| C51 | C61 | H611 | H612 | 117.3° | 120.0° |
| C51 | C61 | N61 | H11A | 54.7° | 66.2° |
| C51 | C61 | N61 | H12A | 180.0° | 180.0° |
| H51 | C51 | C61 | N61 | 120.4° | 54.9° |
| H51 | C51 | C61 | H611 | 114.3° | 65.1° |
| H51 | C51 | C61 | H612 | 4.8° | 174.9° |
| N61 | C61 | H611 | H612 | 117.2° | 120.0° |
| C61 | N61 | H11A | H12A | 125.5° | 113.7° |
| H611 | C61 | N61 | H11A | 180.0° | 53.8° |
| H611 | C61 | N61 | H12A | 54.7° | 60.0° |
| H612 | C61 | N61 | H11A | 70.5° | 173.8° |
| H612 | C61 | N61 | H12A | 54.8° | 60.0° |
| N12 | C12 | C22 | C62 | 120.6° | 120.0° |
| N12 | C12 | C22 | H12 | 120.2° | 120.0° |
| N12 | C12 | C62 | H12 | 120.2° | 120.0° |
| C12 | N12 | H121 | H122 | 123.8° | 113.8° |
| N12 | C12 | C22 | C32 | 179.7° | 180.0° |
| N12 | C12 | C22 | H221 | 55.1° | 60.0° |
| N12 | C12 | C22 | H222 | 54.4° | 60.0° |
| N12 | C12 | C62 | C52 | 179.9° | 180.0° |
| N12 | C12 | C62 | O62 | 60.0° | 60.0° |
| N12 | C12 | C62 | H62 | 60.0° | 60.1° |
| C22 | C12 | C62 | H12 | 119.0° | 120.0° |
| C22 | C12 | N12 | H121 | 54.7° | 60.0° |
| C22 | C12 | N12 | H122 | 180.0° | 53.8° |
| C12 | C22 | C32 | H221 | 125.3° | 120.0° |
| C12 | C22 | C32 | H222 | 125.3° | 120.0° |
| C12 | C22 | H221 | H222 | 118.0° | 120.1° |
| C12 | C22 | C32 | N32 | 180.0° | 180.0° |
| C12 | C22 | C32 | C42 | 58.1° | 60.0° |
| C12 | C22 | C32 | H32 | 61.1° | 60.0° |
| C22 | C12 | C62 | C52 | 59.3° | 60.0° |
| C22 | C12 | C62 | O62 | 179.1° | 180.0° |
| C22 | C12 | C62 | H62 | 60.9° | 59.9° |
| C62 | C12 | N12 | H121 | 67.1° | 180.0° |
| C62 | C12 | N12 | H122 | 58.2° | 66.2° |
| C62 | C12 | C22 | C32 | 59.0° | 60.0° |
| C62 | C12 | C22 | H221 | 175.7° | 59.9° |
| C62 | C12 | C22 | H222 | 66.3° | 180.0° |
| C12 | C62 | C52 | C42 | 59.2° | 60.0° |
| C12 | C62 | C52 | O52 | 179.2° | 180.0° |
| C12 | C62 | C52 | O62 | 120.5° | 120.0° |
| C12 | C62 | C52 | H62 | 119.5° | 120.0° |
| C12 | C62 | C52 | H52 | 60.0° | 60.0° |
| C12 | C62 | O62 | H62 | 119.5° | 120.1° |
| C12 | C62 | O62 | C13 | 97.3° | 92.2° |
| H12 | C12 | N12 | H121 | 173.7° | 60.0° |
| H12 | C12 | N12 | H122 | 61.0° | 173.8° |
| H12 | C12 | C22 | C32 | 60.2° | 60.0° |
| H12 | C12 | C22 | H221 | 65.1° | 180.0° |
| H12 | C12 | C22 | H222 | 174.5° | 60.0° |
| H12 | C12 | C62 | C52 | 59.7° | 60.0° |
| H12 | C12 | C62 | O62 | 60.2° | 60.0° |
| H12 | C12 | C62 | H62 | 179.9° | 179.9° |
| C32 | C22 | H221 | H222 | 118.0° | 120.0° |
| C22 | C32 | N32 | C42 | 121.2° | 120.0° |
| C22 | C32 | N32 | H32 | 119.6° | 120.0° |
| C22 | C32 | C42 | H32 | 119.6° | 120.0° |
| C22 | C32 | N32 | H321 | 54.8° | 52.9° |
| C22 | C32 | N32 | H322 | 180.0° | 166.7° |
| C22 | C32 | C42 | C52 | 58.6° | 60.0° |
| C22 | C32 | C42 | H42 | 60.3° | 60.1° |
| H221 | C22 | C32 | N32 | 54.7° | 60.0° |
| H221 | C22 | C32 | C42 | 176.6° | 60.1° |
| H221 | C22 | C32 | H32 | 64.2° | 180.0° |
| H222 | C22 | C32 | N32 | 54.7° | 60.0° |
| H222 | C22 | C32 | C42 | 67.2° | 180.0° |
| H222 | C22 | C32 | H32 | 173.6° | 60.0° |
| N32 | C32 | C42 | H32 | 118.9° | 120.0° |
| C32 | N32 | H321 | H322 | 124.2° | 113.8° |
| N32 | C32 | C42 | C52 | 179.9° | 180.0° |
| N32 | C32 | C42 | H42 | 61.3° | 60.0° |
| C42 | C32 | N32 | H321 | 176.0° | 173.0° |
| C42 | C32 | N32 | H322 | 58.8° | 73.2° |
| C32 | C42 | C52 | H42 | 119.8° | 120.0° |
| C32 | C42 | C52 | O52 | 179.8° | 180.0° |
| C32 | C42 | C52 | C62 | 59.1° | 60.0° |
| C32 | C42 | C52 | H52 | 60.6° | 60.0° |
| H32 | C32 | N32 | H321 | 64.8° | 67.0° |
| H32 | C32 | N32 | H322 | 60.4° | 46.8° |
| H32 | C32 | C42 | C52 | 61.0° | 60.0° |
| H32 | C32 | C42 | H42 | 179.9° | 179.9° |
| C42 | C52 | O52 | C62 | 121.2° | 120.0° |
| C42 | C52 | O52 | H52 | 119.1° | 120.0° |
| C42 | C52 | C62 | H52 | 119.2° | 120.0° |
| C42 | C52 | O52 | H3 | 180.0° | 171.3° |
| C42 | C52 | C62 | O62 | 179.7° | 180.0° |
| C42 | C52 | C62 | H62 | 60.3° | 60.0° |
| H42 | C42 | C52 | O52 | 60.4° | 60.0° |
| H42 | C42 | C52 | C62 | 60.7° | 60.0° |
| H42 | C42 | C52 | H52 | 179.6° | 180.0° |
| O52 | C52 | C62 | H52 | 119.3° | 120.0° |
| O52 | C52 | C62 | O62 | 58.7° | 60.0° |
| O52 | C52 | C62 | H62 | 61.2° | 60.0° |
| C62 | C52 | O52 | H3 | 58.8° | 68.6° |
| C52 | C62 | O62 | H62 | 120.2° | 120.0° |
| C52 | C62 | O62 | C13 | 142.4° | 147.8° |
| H52 | C52 | O52 | H3 | 60.9° | 51.4° |
| H52 | C52 | C62 | O62 | 60.5° | 60.0° |
| H52 | C52 | C62 | H62 | 179.5° | 180.0° |
| C62 | O62 | C13 | C23 | 155.4° | 165.3° |
| C62 | O62 | C13 | O53 | 85.0° | 74.4° |
| C62 | O62 | C13 | H13 | 33.6° | 45.4° |
| H62 | C62 | O62 | C13 | 22.2° | 27.8° |
| O62 | C13 | C23 | O53 | 120.7° | 120.1° |
| O62 | C13 | C23 | H13 | 120.8° | 119.9° |
| O62 | C13 | O53 | H13 | 120.9° | 119.8° |
| O62 | C13 | C23 | O23 | 59.7° | 61.1° |
| O62 | C13 | C23 | C33 | 61.9° | 58.8° |
| O62 | C13 | C23 | H23 | 178.6° | 178.6° |
| O62 | C13 | O53 | C53 | 58.4° | 52.5° |
| C23 | C13 | O53 | H13 | 121.9° | 120.1° |
| C13 | C23 | O23 | C33 | 119.2° | 119.6° |
| C13 | C23 | O23 | H23 | 121.3° | 120.2° |
| C13 | C23 | C33 | H23 | 121.3° | 119.9° |
| C13 | C23 | O23 | H2 | 180.0° | 60.4° |
| C13 | C23 | C33 | N33 | 178.1° | 173.5° |
| C13 | C23 | C33 | C43 | 59.5° | 53.6° |
| C13 | C23 | C33 | H1 | 59.7° | 66.2° |
| C23 | C13 | O53 | C53 | 58.8° | 67.6° |
| O53 | C13 | C23 | O23 | 179.6° | 178.8° |
| O53 | C13 | C23 | C33 | 58.8° | 61.3° |
| O53 | C13 | C23 | H23 | 60.7° | 58.6° |
| C13 | O53 | C53 | C43 | 55.2° | 67.5° |
| C13 | O53 | C53 | H531 | 179.5° | 172.3° |
| C13 | O53 | C53 | H532 | 70.0° | 52.5° |
| H13 | C13 | C23 | O23 | 61.1° | 58.8° |
| H13 | C13 | C23 | C33 | 177.3° | 178.7° |
| H13 | C13 | C23 | H23 | 57.8° | 61.5° |
| H13 | C13 | O53 | C53 | 179.3° | 172.3° |
| O23 | C23 | C33 | H23 | 118.9° | 120.2° |
| O23 | C23 | C33 | N33 | 58.3° | 66.6° |
| O23 | C23 | C33 | C43 | 179.3° | 173.6° |
| O23 | C23 | C33 | H1 | 60.1° | 53.8° |
| C33 | C23 | O23 | H2 | 60.7° | 180.0° |
| C23 | C33 | N33 | C43 | 122.6° | 119.4° |
| C23 | C33 | N33 | H1 | 118.2° | 120.3° |
| C23 | C33 | C43 | H1 | 118.3° | 119.8° |
| C23 | C33 | N33 | C93 | 79.1° | 85.3° |
| C23 | C33 | N33 | H33 | 155.6° | 160.9° |
| C23 | C33 | C43 | O43 | 62.4° | 66.3° |
| C23 | C33 | C43 | C53 | 56.3° | 53.4° |
| C23 | C33 | C43 | C83 | 179.4° | 173.5° |
| H23 | C23 | O23 | H2 | 58.7° | 59.8° |
| H23 | C23 | C33 | N33 | 60.7° | 53.6° |
| H23 | C23 | C33 | C43 | 61.8° | 66.2° |
| H23 | C23 | C33 | H1 | 179.0° | 174.0° |
| N33 | C33 | C43 | H1 | 118.4° | 120.3° |
| C33 | N33 | C93 | H33 | 125.3° | 113.8° |
| N33 | C33 | C43 | O43 | 60.9° | 53.6° |
| N33 | C33 | C43 | C53 | 179.6° | 173.3° |
| N33 | C33 | C43 | C83 | 57.3° | 66.7° |
| C33 | N33 | C93 | H931 | 54.8° | 180.0° |
| C33 | N33 | C93 | H932 | 180.0° | 60.0° |
| C33 | N33 | C93 | H933 | 54.7° | 60.0° |
| C43 | C33 | N33 | C93 | 158.3° | 155.3° |
| C43 | C33 | N33 | H33 | 33.1° | 41.5° |
| C33 | C43 | O43 | C53 | 119.5° | 119.4° |
| C33 | C43 | O43 | C83 | 126.1° | 120.3° |
| C33 | C43 | C53 | C83 | 128.1° | 120.1° |
| C33 | C43 | O43 | H43 | 180.0° | 179.4° |
| C33 | C43 | C53 | O53 | 51.6° | 61.0° |
| C33 | C43 | C53 | H531 | 176.9° | 178.8° |
| C33 | C43 | C53 | H532 | 73.6° | 59.1° |
| C33 | C43 | C83 | H831 | 54.7° | 59.7° |
| C33 | C43 | C83 | H832 | 180.0° | 60.4° |
| C33 | C43 | C83 | H833 | 54.7° | 179.7° |
| H1 | C33 | N33 | C93 | 39.1° | 35.0° |
| H1 | C33 | N33 | H33 | 86.1° | 78.8° |
| H1 | C33 | C43 | O43 | 179.4° | 173.9° |
| H1 | C33 | C43 | C53 | 62.0° | 66.4° |
| H1 | C33 | C43 | C83 | 61.1° | 53.7° |
| N33 | C93 | H931 | H932 | 129.6° | 120.0° |
| N33 | C93 | H931 | H933 | 115.2° | 120.0° |
| N33 | C93 | H932 | H933 | 125.2° | 120.0° |
| H33 | N33 | C93 | H931 | 180.0° | 66.2° |
| H33 | N33 | C93 | H932 | 54.7° | 53.8° |
| H33 | N33 | C93 | H933 | 70.5° | 173.8° |
| O43 | C43 | C53 | C83 | 111.0° | 120.2° |
| O43 | C43 | C53 | O53 | 69.3° | 58.7° |
| O43 | C43 | C53 | H531 | 56.0° | 61.6° |
| O43 | C43 | C53 | H532 | 165.4° | 178.7° |
| O43 | C43 | C83 | H831 | 67.8° | 179.8° |
| O43 | C43 | C83 | H832 | 57.5° | 59.7° |
| O43 | C43 | C83 | H833 | 177.3° | 60.2° |
| C53 | C43 | O43 | H43 | 60.5° | 60.0° |
| C43 | C53 | O53 | H531 | 125.3° | 120.2° |
| C43 | C53 | O53 | H532 | 125.3° | 120.0° |
| C43 | C53 | H531 | H532 | 117.7° | 119.6° |
| C53 | C43 | C83 | H831 | 178.2° | 60.0° |
| C53 | C43 | C83 | H832 | 56.5° | 179.9° |
| C53 | C43 | C83 | H833 | 68.8° | 60.0° |
| C83 | C43 | O43 | H43 | 53.9° | 60.3° |
| C83 | C43 | C53 | O53 | 179.7° | 178.9° |
| C83 | C43 | C53 | H531 | 55.0° | 58.6° |
| C83 | C43 | C53 | H532 | 54.4° | 61.0° |
| C43 | C83 | H831 | H832 | 129.4° | 120.0° |
| C43 | C83 | H831 | H833 | 115.3° | 119.9° |
| C43 | C83 | H832 | H833 | 125.2° | 120.0° |
| O53 | C53 | H531 | H532 | 117.7° | 119.8° |
| H831 | C83 | H832 | H833 | 109.5° | 120.1° |
| H931 | C93 | H932 | H933 | 109.5° | 120.0° |
