VM2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.55Å | |
| C1 | C6 | sing | 1.53Å | 1.54Å | |
| C1 | C7B | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C5 | C6 | sing | 1.53Å | 1.55Å | |
| C2B | C3B | sing | 1.55Å | 1.55Å | |
| C2B | O2B | sing | 1.43Å | 1.45Å | |
| C2B | CAR | sing | 1.54Å | 1.55Å | |
| C3B | C4B | sing | 1.55Å | 1.52Å | |
| C3B | O3B | sing | 1.43Å | 1.45Å | |
| C4B | C5B | sing | 1.54Å | 1.55Å | |
| C4B | O4B | sing | 1.43Å | 1.44Å | |
| C5B | C6B | sing | 1.53Å | 1.55Å | |
| C5B | CAR | sing | 1.54Å | 1.53Å | |
| C6B | O6B | sing | 1.43Å | 1.45Å | |
| N2B | C7B | sing | 1.47Å | 1.47Å | |
| N2B | CAR | sing | 1.47Å | 1.49Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H21C | sing | 1.09Å | 1.10Å | |
| C2 | H22C | sing | 1.09Å | 1.10Å | |
| C6 | H61C | sing | 1.09Å | 1.10Å | |
| C6 | H62C | sing | 1.09Å | 1.10Å | |
| C7B | H7B1 | sing | 1.09Å | 1.10Å | |
| C7B | H7B2 | sing | 1.09Å | 1.10Å | |
| C3 | H31C | sing | 1.09Å | 1.10Å | |
| C3 | H32C | sing | 1.09Å | 1.10Å | |
| C4 | H41C | sing | 1.09Å | 1.10Å | |
| C4 | H42C | sing | 1.09Å | 1.10Å | |
| C5 | H51C | sing | 1.09Å | 1.10Å | |
| C5 | H52C | sing | 1.09Å | 1.10Å | |
| C2B | H2B | sing | 1.09Å | 1.10Å | |
| C3B | H3B | sing | 1.09Å | 1.10Å | |
| O2B | HA | sing | 0.97Å | 0.95Å | |
| CAR | HAR | sing | 1.09Å | 1.10Å | |
| C4B | H4B | sing | 1.09Å | 1.10Å | |
| O3B | HB | sing | 0.97Å | 0.95Å | |
| C5B | H5B | sing | 1.09Å | 1.10Å | |
| O4B | HC | sing | 0.97Å | 0.95Å | |
| C6B | H6B1 | sing | 1.09Å | 1.10Å | |
| C6B | H6B2 | sing | 1.09Å | 1.10Å | |
| O6B | H6B | sing | 0.97Å | 0.95Å | |
| N2B | HD | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 112.3° | 109.5° |
| C2 | C1 | C7B | 114.4° | 109.5° |
| C1 | C2 | C3 | 118.2° | 109.5° |
| C2 | C1 | H1 | 107.8° | 109.5° |
| C1 | C2 | H21C | 107.3° | 109.5° |
| C1 | C2 | H22C | 107.2° | 109.5° |
| C6 | C1 | C7B | 106.3° | 109.5° |
| C1 | C6 | C5 | 116.8° | 109.4° |
| C6 | C1 | H1 | 107.9° | 109.5° |
| C1 | C6 | H61C | 107.6° | 109.5° |
| C1 | C6 | H62C | 107.6° | 109.5° |
| C1 | C7B | N2B | 119.5° | 109.5° |
| C7B | C1 | H1 | 107.9° | 109.4° |
| C1 | C7B | H7B1 | 106.9° | 109.5° |
| C1 | C7B | H7B2 | 106.9° | 109.4° |
| C2 | C3 | C4 | 113.2° | 109.5° |
| C3 | C2 | H21C | 107.2° | 109.5° |
| C3 | C2 | H22C | 107.3° | 109.5° |
| C2 | C3 | H31C | 108.6° | 109.5° |
| C2 | C3 | H32C | 108.6° | 109.5° |
| C3 | C4 | C5 | 110.4° | 109.5° |
| C4 | C3 | H31C | 108.5° | 109.5° |
| C4 | C3 | H32C | 108.5° | 109.4° |
| C3 | C4 | H41C | 109.3° | 109.4° |
| C3 | C4 | H42C | 109.2° | 109.5° |
| C4 | C5 | C6 | 115.3° | 109.5° |
| C5 | C4 | H41C | 109.2° | 109.5° |
| C5 | C4 | H42C | 109.3° | 109.5° |
| C4 | C5 | H51C | 108.0° | 109.5° |
| C4 | C5 | H52C | 108.0° | 109.5° |
| C5 | C6 | H61C | 107.6° | 109.5° |
| C5 | C6 | H62C | 107.6° | 109.5° |
| C6 | C5 | H51C | 108.0° | 109.4° |
| C6 | C5 | H52C | 108.0° | 109.4° |
| C3B | C2B | O2B | 110.9° | 110.5° |
| C3B | C2B | CAR | 105.2° | 104.2° |
| C2B | C3B | C4B | 102.1° | 102.7° |
| C2B | C3B | O3B | 118.3° | 110.7° |
| C3B | C2B | H2B | 109.9° | 110.5° |
| C2B | C3B | H3B | 106.3° | 110.8° |
| O2B | C2B | CAR | 109.5° | 110.5° |
| O2B | C2B | H2B | 111.3° | 110.4° |
| C2B | O2B | HA | 109.5° | 114.0° |
| C2B | CAR | C5B | 104.3° | 106.6° |
| C2B | CAR | N2B | 116.7° | 110.1° |
| CAR | C2B | H2B | 109.9° | 110.6° |
| C2B | CAR | HAR | 106.8° | 110.1° |
| C4B | C3B | O3B | 115.1° | 110.8° |
| C3B | C4B | C5B | 99.2° | 104.2° |
| C3B | C4B | O4B | 116.2° | 110.5° |
| C4B | C3B | H3B | 106.7° | 110.8° |
| C3B | C4B | H4B | 109.6° | 110.5° |
| O3B | C3B | H3B | 107.6° | 110.8° |
| C3B | O3B | HB | 109.5° | 114.0° |
| C5B | C4B | O4B | 111.3° | 110.5° |
| C4B | C5B | C6B | 116.2° | 110.0° |
| C4B | C5B | CAR | 102.9° | 106.6° |
| C5B | C4B | H4B | 109.2° | 110.5° |
| C4B | C5B | H5B | 107.2° | 110.0° |
| O4B | C4B | H4B | 110.7° | 110.5° |
| C4B | O4B | HC | 109.5° | 114.0° |
| C6B | C5B | CAR | 115.4° | 110.0° |
| C5B | C6B | O6B | 111.3° | 109.5° |
| C6B | C5B | H5B | 107.2° | 110.0° |
| C5B | C6B | H6B1 | 109.0° | 109.5° |
| C5B | C6B | H6B2 | 109.0° | 109.4° |
| C5B | CAR | N2B | 113.9° | 110.0° |
| C5B | CAR | HAR | 107.1° | 110.0° |
| CAR | C5B | H5B | 107.4° | 110.1° |
| O6B | C6B | H6B1 | 109.0° | 109.5° |
| O6B | C6B | H6B2 | 109.0° | 109.4° |
| C6B | O6B | H6B | 109.5° | 114.0° |
| C7B | N2B | CAR | 118.8° | 111.0° |
| N2B | C7B | H7B1 | 106.9° | 109.5° |
| N2B | C7B | H7B2 | 106.9° | 109.5° |
| C7B | N2B | HD | 107.1° | 111.0° |
| N2B | CAR | HAR | 107.5° | 110.1° |
| CAR | N2B | HD | 107.1° | 111.0° |
| H21C | C2 | H22C | 109.4° | 109.4° |
| H61C | C6 | H62C | 109.5° | 109.5° |
| H7B1 | C7B | H7B2 | 109.5° | 109.5° |
| H31C | C3 | H32C | 109.5° | 109.4° |
| H41C | C4 | H42C | 109.4° | 109.5° |
| H51C | C5 | H52C | 109.4° | 109.5° |
| H6B1 | C6B | H6B2 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | C7B | 125.8° | 120.0° |
| C2 | C1 | C6 | H1 | 118.6° | 120.0° |
| C2 | C1 | C7B | H1 | 119.9° | 120.0° |
| C1 | C2 | C3 | H21C | 121.3° | 120.0° |
| C1 | C2 | C3 | H22C | 121.3° | 120.1° |
| C1 | C2 | C3 | C4 | 15.2° | 59.9° |
| C2 | C1 | C6 | C5 | 40.3° | 60.0° |
| C2 | C1 | C7B | N2B | 2.8° | 175.0° |
| C1 | C2 | H21C | H22C | 116.0° | 120.0° |
| C2 | C1 | C6 | H61C | 161.4° | 180.0° |
| C2 | C1 | C6 | H62C | 80.8° | 60.0° |
| C2 | C1 | C7B | H7B1 | 118.6° | 55.0° |
| C2 | C1 | C7B | H7B2 | 124.2° | 65.0° |
| C1 | C2 | C3 | H31C | 105.3° | 180.0° |
| C1 | C2 | C3 | H32C | 135.8° | 60.0° |
| C6 | C1 | C7B | H1 | 115.5° | 120.0° |
| C6 | C1 | C2 | C3 | 32.0° | 60.0° |
| C1 | C6 | C5 | C4 | 1.2° | 60.0° |
| C1 | C6 | C5 | H61C | 121.1° | 120.0° |
| C1 | C6 | C5 | H62C | 121.1° | 120.0° |
| C6 | C1 | C7B | N2B | 127.3° | 65.0° |
| C6 | C1 | C2 | H21C | 89.3° | 60.0° |
| C6 | C1 | C2 | H22C | 153.2° | 180.0° |
| C1 | C6 | H61C | H62C | 116.7° | 120.0° |
| C6 | C1 | C7B | H7B1 | 5.9° | 175.0° |
| C6 | C1 | C7B | H7B2 | 111.3° | 55.0° |
| C1 | C6 | C5 | H51C | 122.0° | 180.0° |
| C1 | C6 | C5 | H52C | 119.7° | 60.0° |
| C7B | C1 | C2 | C3 | 153.3° | 180.0° |
| C7B | C1 | C6 | C5 | 166.1° | 180.0° |
| C1 | C7B | N2B | H7B1 | 121.4° | 120.0° |
| C1 | C7B | N2B | H7B2 | 121.4° | 120.0° |
| C1 | C7B | N2B | CAR | 172.1° | 180.0° |
| C7B | C1 | C2 | H21C | 32.0° | 60.0° |
| C7B | C1 | C2 | H22C | 85.5° | 60.0° |
| C7B | C1 | C6 | H61C | 72.8° | 60.0° |
| C7B | C1 | C6 | H62C | 45.1° | 60.0° |
| C1 | C7B | H7B1 | H7B2 | 115.5° | 120.0° |
| C1 | C7B | N2B | HD | 50.7° | 56.1° |
| C2 | C3 | C4 | H31C | 120.6° | 120.0° |
| C2 | C3 | C4 | H32C | 120.6° | 120.0° |
| C2 | C3 | C4 | C5 | 54.7° | 60.0° |
| C3 | C2 | C1 | H1 | 86.7° | 60.1° |
| C3 | C2 | H21C | H22C | 116.0° | 120.0° |
| C2 | C3 | H31C | H32C | 118.4° | 120.0° |
| C2 | C3 | C4 | H41C | 174.9° | 60.0° |
| C2 | C3 | C4 | H42C | 65.4° | 180.0° |
| C3 | C4 | C5 | H41C | 120.2° | 119.9° |
| C3 | C4 | C5 | H42C | 120.1° | 120.1° |
| C3 | C4 | C5 | C6 | 46.7° | 60.0° |
| C4 | C3 | C2 | H21C | 136.5° | 60.0° |
| C4 | C3 | C2 | H22C | 106.0° | 180.0° |
| C4 | C3 | H31C | H32C | 118.3° | 119.9° |
| C3 | C4 | H41C | H42C | 119.6° | 120.0° |
| C3 | C4 | C5 | H51C | 74.2° | 179.9° |
| C3 | C4 | C5 | H52C | 167.5° | 60.0° |
| C4 | C5 | C6 | H51C | 120.9° | 120.0° |
| C4 | C5 | C6 | H52C | 120.9° | 120.0° |
| C4 | C5 | C6 | H61C | 122.2° | 180.0° |
| C4 | C5 | C6 | H62C | 119.9° | 60.0° |
| C5 | C4 | C3 | H31C | 65.8° | 180.0° |
| C5 | C4 | C3 | H32C | 175.3° | 60.0° |
| C5 | C4 | H41C | H42C | 119.6° | 120.0° |
| C4 | C5 | H51C | H52C | 117.3° | 120.0° |
| C5 | C6 | C1 | H1 | 78.3° | 60.1° |
| C5 | C6 | H61C | H62C | 116.6° | 120.0° |
| C6 | C5 | C4 | H41C | 166.9° | 60.0° |
| C6 | C5 | C4 | H42C | 73.4° | 180.0° |
| C6 | C5 | H51C | H52C | 117.3° | 120.0° |
| C3B | C2B | O2B | CAR | 115.6° | 114.8° |
| C3B | C2B | O2B | H2B | 122.7° | 122.5° |
| C3B | C2B | CAR | H2B | 118.2° | 118.8° |
| C2B | C3B | C4B | O3B | 129.5° | 118.3° |
| C2B | C3B | C4B | H3B | 111.3° | 118.3° |
| C2B | C3B | O3B | H3B | 120.3° | 123.3° |
| C2B | C3B | C4B | C5B | 48.0° | 38.0° |
| C2B | C3B | C4B | O4B | 167.3° | 156.6° |
| C3B | C2B | CAR | C5B | 0.3° | 23.6° |
| C3B | C2B | CAR | N2B | 126.3° | 142.9° |
| C3B | C2B | O2B | HA | 180.0° | 61.5° |
| C3B | C2B | CAR | HAR | 113.4° | 95.6° |
| C2B | C3B | C4B | H4B | 66.2° | 80.7° |
| C2B | C3B | O3B | HB | 180.0° | 180.0° |
| O2B | C2B | CAR | H2B | 122.5° | 122.6° |
| O2B | C2B | C3B | C4B | 148.4° | 156.6° |
| O2B | C2B | C3B | O3B | 84.2° | 85.1° |
| O2B | C2B | CAR | C5B | 118.9° | 142.3° |
| O2B | C2B | CAR | N2B | 114.4° | 98.4° |
| O2B | C2B | C3B | H3B | 36.8° | 38.3° |
| O2B | C2B | CAR | HAR | 5.8° | 23.0° |
| CAR | C2B | C3B | C4B | 30.1° | 38.0° |
| CAR | C2B | C3B | O3B | 157.6° | 156.3° |
| C2B | CAR | C5B | C4B | 30.1° | 0.0° |
| C2B | CAR | C5B | C6B | 157.6° | 119.3° |
| C2B | CAR | C5B | N2B | 128.4° | 119.3° |
| C2B | CAR | C5B | HAR | 113.0° | 119.3° |
| C2B | CAR | N2B | C7B | 161.3° | 86.4° |
| C2B | CAR | N2B | HAR | 119.9° | 121.5° |
| CAR | C2B | C3B | H3B | 81.5° | 80.4° |
| CAR | C2B | O2B | HA | 64.4° | 176.3° |
| C2B | CAR | C5B | H5B | 82.9° | 119.3° |
| C2B | CAR | N2B | HD | 40.0° | 37.5° |
| C4B | C3B | O3B | H3B | 118.7° | 123.4° |
| C3B | C4B | C5B | O4B | 122.9° | 118.7° |
| C3B | C4B | C5B | H4B | 114.6° | 118.7° |
| C3B | C4B | O4B | H4B | 125.9° | 122.6° |
| C3B | C4B | C5B | C6B | 176.0° | 142.9° |
| C3B | C4B | C5B | CAR | 48.9° | 23.6° |
| C4B | C3B | C2B | H2B | 88.1° | 80.9° |
| C4B | C3B | O3B | HB | 59.0° | 66.7° |
| C3B | C4B | C5B | H5B | 64.2° | 95.7° |
| C3B | C4B | O4B | HC | 180.0° | 61.4° |
| O3B | C3B | C4B | C5B | 177.5° | 156.2° |
| O3B | C3B | C4B | O4B | 63.2° | 85.1° |
| O3B | C3B | C2B | H2B | 39.3° | 37.4° |
| O3B | C3B | C4B | H4B | 63.2° | 37.5° |
| C5B | C4B | O4B | H4B | 121.6° | 122.6° |
| C4B | C5B | C6B | CAR | 120.6° | 117.1° |
| C4B | C5B | C6B | H5B | 119.8° | 121.4° |
| C4B | C5B | CAR | H5B | 113.0° | 119.3° |
| C4B | C5B | C6B | O6B | 38.2° | 66.5° |
| C4B | C5B | CAR | N2B | 98.3° | 119.3° |
| C5B | C4B | C3B | H3B | 63.3° | 80.4° |
| C4B | C5B | CAR | HAR | 143.0° | 119.3° |
| C5B | C4B | O4B | HC | 67.5° | 176.2° |
| C4B | C5B | C6B | H6B1 | 158.5° | 53.6° |
| C4B | C5B | C6B | H6B2 | 82.1° | 173.6° |
| O4B | C4B | C5B | C6B | 61.1° | 98.4° |
| O4B | C4B | C5B | CAR | 171.8° | 142.3° |
| O4B | C4B | C3B | H3B | 56.0° | 38.3° |
| O4B | C4B | C5B | H5B | 58.7° | 23.0° |
| C6B | C5B | CAR | H5B | 119.5° | 121.4° |
| C5B | C6B | O6B | H6B1 | 120.3° | 120.1° |
| C5B | C6B | O6B | H6B2 | 120.3° | 119.9° |
| C6B | C5B | CAR | N2B | 29.3° | 0.1° |
| C6B | C5B | CAR | HAR | 89.4° | 121.5° |
| C6B | C5B | C4B | H4B | 61.4° | 24.3° |
| C5B | C6B | H6B1 | H6B2 | 119.2° | 120.0° |
| C5B | C6B | O6B | H6B | 180.0° | 180.0° |
| CAR | C5B | C6B | O6B | 82.4° | 176.4° |
| C5B | CAR | N2B | C7B | 77.0° | 156.4° |
| C5B | CAR | N2B | HAR | 118.4° | 121.4° |
| C5B | CAR | C2B | H2B | 118.5° | 95.2° |
| CAR | C5B | C4B | H4B | 65.7° | 95.0° |
| CAR | C5B | C6B | H6B1 | 37.9° | 63.6° |
| CAR | C5B | C6B | H6B2 | 157.3° | 56.4° |
| C5B | CAR | N2B | HD | 161.7° | 79.7° |
| O6B | C6B | C5B | H5B | 158.0° | 54.9° |
| O6B | C6B | H6B1 | H6B2 | 119.2° | 120.0° |
| C7B | N2B | CAR | HD | 121.3° | 123.9° |
| N2B | C7B | C1 | H1 | 117.2° | 55.0° |
| N2B | C7B | H7B1 | H7B2 | 115.4° | 120.0° |
| C7B | N2B | CAR | HAR | 41.4° | 35.0° |
| CAR | N2B | C7B | H7B1 | 66.5° | 60.0° |
| CAR | N2B | C7B | H7B2 | 50.7° | 60.0° |
| N2B | CAR | C2B | H2B | 8.1° | 24.1° |
| N2B | CAR | C5B | H5B | 148.7° | 121.4° |
| H1 | C1 | C2 | H21C | 152.0° | 179.9° |
| H1 | C1 | C2 | H22C | 34.6° | 60.0° |
| H1 | C1 | C6 | H61C | 42.8° | 59.9° |
| H1 | C1 | C6 | H62C | 160.6° | 179.9° |
| H1 | C1 | C7B | H7B1 | 121.4° | 65.0° |
| H1 | C1 | C7B | H7B2 | 4.2° | 175.0° |
| H21C | C2 | C3 | H31C | 16.0° | 60.0° |
| H21C | C2 | C3 | H32C | 103.0° | NaN° |
| H22C | C2 | C3 | H31C | 133.4° | 59.9° |
| H22C | C2 | C3 | H32C | 14.5° | 60.0° |
| H61C | C6 | C5 | H51C | 116.9° | 60.0° |
| H61C | C6 | C5 | H52C | 1.3° | 59.9° |
| H62C | C6 | C5 | H51C | 1.0° | 60.0° |
| H62C | C6 | C5 | H52C | 119.2° | 180.0° |
| H7B1 | C7B | N2B | HD | 172.2° | 176.1° |
| H7B2 | C7B | N2B | HD | 70.7° | 63.9° |
| H31C | C3 | C4 | H41C | 54.3° | 60.0° |
| H31C | C3 | C4 | H42C | 174.0° | 60.0° |
| H32C | C3 | C4 | H41C | 64.5° | 180.0° |
| H32C | C3 | C4 | H42C | 55.2° | 60.0° |
| H41C | C4 | C5 | H51C | 46.0° | 60.0° |
| H41C | C4 | C5 | H52C | 72.3° | 180.0° |
| H42C | C4 | C5 | H51C | 165.7° | 60.0° |
| H42C | C4 | C5 | H52C | 47.4° | 60.0° |
| H2B | C2B | C3B | H3B | 160.3° | 160.8° |
| H2B | C2B | O2B | HA | 57.3° | 61.1° |
| H2B | C2B | CAR | HAR | 128.3° | 145.6° |
| H3B | C3B | C4B | H4B | 177.6° | 161.0° |
| H3B | C3B | O3B | HB | 59.8° | 56.7° |
| HAR | CAR | C5B | H5B | 30.1° | 0.0° |
| HAR | CAR | N2B | HD | 79.9° | 158.9° |
| H4B | C4B | C5B | H5B | 178.8° | 145.6° |
| H4B | C4B | O4B | HC | 54.1° | 61.1° |
| H5B | C5B | C6B | H6B1 | 81.7° | 174.9° |
| H5B | C5B | C6B | H6B2 | 37.7° | 65.0° |
| H6B1 | C6B | O6B | H6B | 59.7° | 59.9° |
| H6B2 | C6B | O6B | H6B | 59.8° | 60.1° |
