BJ9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O07 | C06 | doub | 1.22Å | 1.17Å | |
| N05 | C06 | sing | 1.34Å | 1.53Å | |
| N05 | C03 | sing | 1.35Å | 1.45Å | |
| C06 | N08 | sing | 1.34Å | 1.54Å | |
| O04 | C03 | doub | 1.22Å | 1.16Å | |
| O33 | C10 | sing | 1.43Å | 1.50Å | |
| C03 | C02 | sing | 1.47Å | 1.46Å | |
| N08 | C09 | sing | 1.47Å | 1.47Å | |
| N08 | C01 | sing | 1.36Å | 1.46Å | |
| C09 | C10 | sing | 1.55Å | 1.31Å | |
| C09 | O13 | sing | 1.44Å | 1.61Å | |
| C10 | C11 | sing | 1.55Å | 1.52Å | |
| C02 | C01 | doub | 1.38Å | 1.46Å | |
| C02 | C34 | sing | 1.47Å | 1.52Å | |
| O32 | C11 | sing | 1.43Å | 1.33Å | |
| C34 | O36 | doub | 1.22Å | 1.27Å | |
| C34 | O35 | sing | 1.35Å | 1.24Å | |
| C11 | C12 | sing | 1.54Å | 1.54Å | |
| O13 | C12 | sing | 1.44Å | 1.29Å | |
| C12 | C14 | sing | 1.53Å | 1.52Å | |
| C14 | N18 | sing | 1.46Å | 1.50Å | |
| C14 | C15 | sing | 1.51Å | 1.51Å | |
| O16 | C15 | doub | 1.21Å | 1.28Å | |
| N18 | C19 | sing | 1.35Å | 1.50Å | |
| C15 | O17 | sing | 1.34Å | 1.24Å | |
| O20 | C19 | doub | 1.21Å | 1.20Å | |
| N31 | C21 | sing | 1.47Å | 1.48Å | |
| C19 | C21 | sing | 1.51Å | 1.50Å | |
| C21 | C22 | sing | 1.53Å | 1.53Å | |
| C22 | O30 | sing | 1.43Å | 1.37Å | |
| C22 | C23 | sing | 1.53Å | 1.55Å | |
| C23 | C24 | sing | 1.53Å | 1.53Å | |
| C23 | O29 | sing | 1.43Å | 1.38Å | |
| C24 | O25 | sing | 1.45Å | 1.43Å | |
| O27 | C26 | doub | 1.21Å | 1.17Å | |
| O25 | C26 | sing | 1.35Å | 1.40Å | |
| C26 | N28 | sing | 1.35Å | 1.45Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| N05 | H051 | sing | 0.97Å | 1.00Å | |
| N18 | H181 | sing | 0.97Å | 1.00Å | |
| N28 | H281 | sing | 0.97Å | 1.00Å | |
| N28 | H282 | sing | 0.97Å | 1.00Å | |
| N31 | H311 | sing | 1.01Å | 1.00Å | |
| N31 | H1 | sing | 1.01Å | 1.00Å | |
| O17 | H2 | sing | 0.97Å | 0.95Å | |
| O29 | H291 | sing | 0.97Å | 0.95Å | |
| O30 | H301 | sing | 0.97Å | 0.95Å | |
| O32 | H321 | sing | 0.97Å | 0.95Å | |
| O33 | H331 | sing | 0.97Å | 0.95Å | |
| O35 | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O07 | C06 | N05 | 122.5° | 118.9° |
| O07 | C06 | N08 | 122.9° | 119.0° |
| C06 | N05 | C03 | 122.1° | 120.4° |
| N05 | C06 | N08 | 114.6° | 122.1° |
| C06 | N05 | H051 | 119.0° | 119.8° |
| N05 | C03 | O04 | 119.9° | 120.8° |
| N05 | C03 | C02 | 120.9° | 118.5° |
| C03 | N05 | H051 | 118.9° | 119.8° |
| C06 | N08 | C09 | 118.6° | 119.2° |
| C06 | N08 | C01 | 121.3° | 121.6° |
| O04 | C03 | C02 | 119.2° | 120.7° |
| O33 | C10 | C09 | 111.9° | 110.9° |
| O33 | C10 | C11 | 109.2° | 110.8° |
| O33 | C10 | H101 | 109.7° | 110.8° |
| C10 | O33 | H331 | 109.5° | 114.0° |
| C03 | C02 | C01 | 120.0° | 118.0° |
| C03 | C02 | C34 | 120.0° | 121.0° |
| C09 | N08 | C01 | 120.1° | 119.3° |
| N08 | C09 | C10 | 113.2° | 110.6° |
| N08 | C09 | O13 | 108.9° | 110.7° |
| N08 | C09 | H091 | 109.2° | 110.7° |
| N08 | C01 | C02 | 121.0° | 119.3° |
| N08 | C01 | H011 | 119.5° | 120.4° |
| C10 | C09 | O13 | 106.2° | 103.5° |
| C09 | C10 | C11 | 103.7° | 102.1° |
| C09 | C10 | H101 | 112.7° | 110.9° |
| C10 | C09 | H091 | 111.6° | 110.6° |
| C09 | O13 | C12 | 108.4° | 107.0° |
| O13 | C09 | H091 | 107.4° | 110.6° |
| C10 | C11 | O32 | 109.5° | 110.5° |
| C10 | C11 | C12 | 104.3° | 104.1° |
| C11 | C10 | H101 | 109.5° | 110.9° |
| C10 | C11 | H111 | 110.0° | 110.5° |
| C01 | C02 | C34 | 120.0° | 121.0° |
| C02 | C01 | H011 | 119.5° | 120.3° |
| C02 | C34 | O36 | 120.1° | 120.0° |
| C02 | C34 | O35 | 119.9° | 120.1° |
| O32 | C11 | C12 | 110.1° | 110.5° |
| O32 | C11 | H111 | 112.9° | 110.6° |
| C11 | O32 | H321 | 109.5° | 114.0° |
| O36 | C34 | O35 | 120.0° | 120.0° |
| C34 | O35 | H3 | 109.5° | 117.0° |
| C11 | C12 | O13 | 105.9° | 107.3° |
| C11 | C12 | C14 | 112.0° | 109.9° |
| C12 | C11 | H111 | 109.7° | 110.5° |
| C11 | C12 | H121 | 108.7° | 109.9° |
| O13 | C12 | C14 | 108.5° | 109.9° |
| O13 | C12 | H121 | 112.7° | 110.0° |
| C12 | C14 | N18 | 110.3° | 109.5° |
| C12 | C14 | C15 | 108.1° | 109.5° |
| C14 | C12 | H121 | 109.1° | 109.8° |
| C12 | C14 | H141 | 108.9° | 109.4° |
| N18 | C14 | C15 | 111.1° | 109.5° |
| C14 | N18 | C19 | 120.4° | 120.0° |
| N18 | C14 | H141 | 109.2° | 109.5° |
| C14 | N18 | H181 | 119.8° | 120.0° |
| C14 | C15 | O16 | 119.6° | 120.0° |
| C14 | C15 | O17 | 120.7° | 120.0° |
| C15 | C14 | H141 | 109.2° | 109.5° |
| O16 | C15 | O17 | 119.7° | 120.0° |
| N18 | C19 | O20 | 120.0° | 120.0° |
| N18 | C19 | C21 | 120.2° | 120.0° |
| C19 | N18 | H181 | 119.8° | 120.0° |
| C15 | O17 | H2 | 109.5° | 117.0° |
| O20 | C19 | C21 | 119.9° | 120.0° |
| N31 | C21 | C19 | 109.1° | 109.5° |
| N31 | C21 | C22 | 109.5° | 109.4° |
| N31 | C21 | H211 | 109.9° | 109.5° |
| C21 | N31 | H311 | 109.5° | 111.0° |
| C21 | N31 | H1 | 109.5° | 111.0° |
| C19 | C21 | C22 | 109.8° | 109.5° |
| C19 | C21 | H211 | 109.5° | 109.5° |
| C21 | C22 | O30 | 109.0° | 109.5° |
| C21 | C22 | C23 | 109.4° | 109.5° |
| C22 | C21 | H211 | 109.1° | 109.5° |
| C21 | C22 | H221 | 108.9° | 109.5° |
| O30 | C22 | C23 | 109.6° | 109.5° |
| O30 | C22 | H221 | 111.2° | 109.4° |
| C22 | O30 | H301 | 109.5° | 114.0° |
| C22 | C23 | C24 | 110.1° | 109.5° |
| C22 | C23 | O29 | 109.4° | 109.5° |
| C23 | C22 | H221 | 108.7° | 109.5° |
| C22 | C23 | H231 | 108.6° | 109.4° |
| C24 | C23 | O29 | 108.9° | 109.5° |
| C23 | C24 | O25 | 108.2° | 109.5° |
| C23 | C24 | H241 | 109.8° | 109.4° |
| C23 | C24 | H242 | 109.8° | 109.5° |
| C24 | C23 | H231 | 108.9° | 109.4° |
| O29 | C23 | H231 | 110.9° | 109.5° |
| C23 | O29 | H291 | 109.5° | 114.0° |
| C24 | O25 | C26 | 114.5° | 117.0° |
| O25 | C24 | H241 | 109.8° | 109.5° |
| O25 | C24 | H242 | 109.8° | 109.5° |
| O27 | C26 | O25 | 120.2° | 120.0° |
| O27 | C26 | N28 | 119.7° | 120.0° |
| O25 | C26 | N28 | 120.1° | 120.0° |
| C26 | N28 | H281 | 120.0° | 120.0° |
| C26 | N28 | H282 | 120.0° | 120.0° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H281 | N28 | H282 | 120.0° | 120.0° |
| H311 | N31 | H1 | 109.5° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O07 | C06 | N05 | N08 | 179.7° | 179.9° |
| O07 | C06 | N05 | C03 | 180.0° | 179.8° |
| O07 | C06 | N08 | C09 | 0.6° | 0.0° |
| O07 | C06 | N08 | C01 | 179.5° | 179.5° |
| O07 | C06 | N05 | H051 | 0.0° | 0.1° |
| C06 | N05 | C03 | H051 | 180.0° | 179.9° |
| C06 | N05 | C03 | O04 | 179.9° | 179.9° |
| C06 | N05 | C03 | C02 | 0.2° | 0.1° |
| N05 | C06 | N08 | C09 | 179.7° | 180.0° |
| N05 | C06 | N08 | C01 | 0.8° | 0.4° |
| C03 | N05 | C06 | N08 | 0.4° | 0.1° |
| N05 | C03 | O04 | C02 | 179.9° | 180.0° |
| N05 | C03 | C02 | C01 | 0.4° | 0.0° |
| N05 | C03 | C02 | C34 | 180.0° | 179.9° |
| C06 | N08 | C09 | C01 | 179.0° | 179.6° |
| C06 | N08 | C09 | C10 | 122.2° | 65.0° |
| C06 | N08 | C09 | O13 | 119.9° | 49.0° |
| C06 | N08 | C01 | C02 | 1.0° | 0.4° |
| C06 | N08 | C01 | H011 | 178.9° | 179.8° |
| C06 | N08 | C09 | H091 | 2.8° | 172.0° |
| N08 | C06 | N05 | H051 | 179.7° | 180.0° |
| O04 | C03 | C02 | C01 | 179.7° | 180.0° |
| O04 | C03 | C02 | C34 | 0.1° | 0.1° |
| O04 | C03 | N05 | H051 | 0.1° | 0.2° |
| O33 | C10 | C09 | N08 | 91.9° | 86.3° |
| O33 | C10 | C09 | C11 | 117.5° | 118.2° |
| O33 | C10 | C09 | H101 | 124.2° | 123.6° |
| O33 | C10 | C09 | O13 | 148.6° | 155.2° |
| O33 | C10 | C11 | H101 | 120.1° | 123.5° |
| O33 | C10 | C11 | O32 | 35.6° | 20.4° |
| O33 | C10 | C11 | C12 | 153.4° | 139.1° |
| O33 | C10 | C09 | H091 | 31.8° | 36.7° |
| O33 | C10 | C11 | H111 | 89.1° | 102.3° |
| C03 | C02 | C01 | N08 | 0.8° | 0.2° |
| C03 | C02 | C01 | C34 | 179.6° | 179.9° |
| C03 | C02 | C34 | O36 | 42.4° | 180.0° |
| C03 | C02 | C34 | O35 | 137.1° | 0.1° |
| C03 | C02 | C01 | H011 | 179.2° | 180.0° |
| C02 | C03 | N05 | H051 | 179.8° | 179.8° |
| N08 | C09 | C10 | O13 | 119.5° | 118.5° |
| N08 | C09 | C10 | H091 | 123.7° | 123.0° |
| N08 | C09 | O13 | H091 | 118.2° | 123.0° |
| N08 | C09 | C10 | C11 | 150.6° | 155.6° |
| C09 | N08 | C01 | C02 | 180.0° | 180.0° |
| N08 | C09 | O13 | C12 | 140.5° | 158.6° |
| N08 | C09 | C10 | H101 | 32.2° | 37.4° |
| C09 | N08 | C01 | H011 | 0.0° | 0.2° |
| C01 | N08 | C09 | C10 | 58.8° | 114.5° |
| C01 | N08 | C09 | O13 | 59.0° | 131.4° |
| N08 | C01 | C02 | H011 | 180.0° | 179.8° |
| N08 | C01 | C02 | C34 | 179.6° | 179.8° |
| C01 | N08 | C09 | H091 | 176.1° | 8.4° |
| C10 | C09 | O13 | H091 | 119.6° | 118.5° |
| C09 | C10 | C11 | H101 | 120.5° | 118.2° |
| C09 | C10 | C11 | O32 | 83.8° | 97.8° |
| C09 | C10 | C11 | C12 | 34.0° | 20.9° |
| C10 | C09 | O13 | C12 | 18.3° | 40.0° |
| C09 | C10 | C11 | H111 | 151.5° | 139.5° |
| C09 | C10 | O33 | H331 | 180.0° | 174.2° |
| O13 | C09 | C10 | C11 | 31.1° | 37.0° |
| C09 | O13 | C12 | C11 | 4.1° | 26.5° |
| C09 | O13 | C12 | C14 | 116.3° | 145.9° |
| O13 | C09 | C10 | H101 | 87.2° | 81.2° |
| C09 | O13 | C12 | H121 | 122.9° | 93.1° |
| C10 | C11 | O32 | C12 | 114.1° | 114.7° |
| C10 | C11 | O32 | H111 | 123.0° | 122.7° |
| C10 | C11 | C12 | H111 | 117.8° | 118.6° |
| C10 | C11 | C12 | O13 | 22.3° | 2.0° |
| C10 | C11 | C12 | C14 | 95.8° | 121.4° |
| C11 | C10 | C09 | H091 | 85.7° | 81.5° |
| C10 | C11 | C12 | H121 | 143.6° | 117.6° |
| C10 | C11 | O32 | H321 | 180.0° | 61.5° |
| C11 | C10 | O33 | H331 | 65.8° | 61.5° |
| C01 | C02 | C34 | O36 | 137.1° | 0.0° |
| C01 | C02 | C34 | O35 | 43.3° | 180.0° |
| C02 | C34 | O36 | O35 | 179.6° | 179.9° |
| C34 | C02 | C01 | H011 | 0.4° | 0.1° |
| C02 | C34 | O35 | H3 | 179.5° | 179.9° |
| O32 | C11 | C12 | H111 | 124.9° | 122.7° |
| O32 | C11 | C12 | O13 | 95.1° | 120.7° |
| O32 | C11 | C12 | C14 | 146.8° | 119.9° |
| O32 | C11 | C10 | H101 | 155.7° | 144.0° |
| O32 | C11 | C12 | H121 | 26.2° | 1.1° |
| O36 | C34 | O35 | H3 | 0.0° | 0.0° |
| C11 | C12 | O13 | C14 | 120.4° | 119.5° |
| C11 | C12 | O13 | H121 | 118.7° | 119.5° |
| C11 | C12 | C14 | H121 | 120.4° | 121.0° |
| C11 | C12 | C14 | N18 | 56.1° | 175.0° |
| C11 | C12 | C14 | C15 | 177.7° | 65.0° |
| C12 | C11 | C10 | H101 | 86.5° | 97.3° |
| C11 | C12 | C14 | H141 | 63.7° | 55.0° |
| C12 | C11 | O32 | H321 | 65.9° | 176.2° |
| O13 | C12 | C14 | H121 | 123.1° | 121.1° |
| O13 | C12 | C14 | N18 | 172.6° | 67.1° |
| O13 | C12 | C14 | C15 | 65.7° | 52.9° |
| C12 | O13 | C09 | H091 | 101.2° | 78.5° |
| O13 | C12 | C11 | H111 | 140.0° | 116.6° |
| O13 | C12 | C14 | H141 | 52.8° | 172.9° |
| C12 | C14 | N18 | C15 | 119.8° | 120.0° |
| C12 | C14 | N18 | H141 | 119.7° | 120.0° |
| C12 | C14 | C15 | H141 | 118.3° | 120.0° |
| C12 | C14 | C15 | O16 | 71.0° | 120.0° |
| C12 | C14 | N18 | C19 | 60.5° | 155.0° |
| C12 | C14 | C15 | O17 | 108.8° | 60.0° |
| C14 | C12 | C11 | H111 | 21.9° | 2.8° |
| C12 | C14 | N18 | H181 | 119.6° | 25.0° |
| N18 | C14 | C15 | H141 | 120.5° | 120.0° |
| N18 | C14 | C15 | O16 | 167.9° | 0.0° |
| C14 | N18 | C19 | H181 | 180.0° | 180.0° |
| N18 | C14 | C15 | O17 | 12.3° | 180.0° |
| C14 | N18 | C19 | O20 | 0.7° | 0.0° |
| C14 | N18 | C19 | C21 | 179.5° | 180.0° |
| N18 | C14 | C12 | H121 | 64.3° | 54.0° |
| C14 | C15 | O16 | O17 | 179.8° | 179.9° |
| C15 | C14 | N18 | C19 | 59.4° | 85.0° |
| C15 | C14 | C12 | H121 | 57.4° | 174.0° |
| C15 | C14 | N18 | H181 | 120.6° | 95.0° |
| C14 | C15 | O17 | H2 | 179.8° | 180.0° |
| O16 | C15 | C14 | H141 | 47.3° | 120.0° |
| O16 | C15 | O17 | H2 | 0.0° | 0.1° |
| N18 | C19 | O20 | C21 | 179.8° | 180.0° |
| N18 | C19 | C21 | N31 | 35.0° | 160.0° |
| N18 | C19 | C21 | C22 | 85.0° | 80.0° |
| N18 | C19 | C21 | H211 | 155.3° | 40.0° |
| C19 | N18 | C14 | H141 | 179.9° | 35.0° |
| O17 | C15 | C14 | H141 | 132.8° | 60.0° |
| O20 | C19 | C21 | N31 | 145.2° | 20.0° |
| O20 | C19 | C21 | C22 | 94.8° | 100.0° |
| O20 | C19 | C21 | H211 | 24.9° | 140.0° |
| O20 | C19 | N18 | H181 | 179.3° | 180.0° |
| N31 | C21 | C19 | C22 | 119.9° | 120.0° |
| N31 | C21 | C19 | H211 | 120.3° | 120.0° |
| N31 | C21 | C22 | H211 | 120.3° | 120.0° |
| N31 | C21 | C22 | O30 | 22.3° | 65.0° |
| N31 | C21 | C22 | C23 | 97.6° | 55.0° |
| N31 | C21 | C22 | H221 | 143.8° | 175.0° |
| C21 | N31 | H311 | H1 | 120.0° | 123.9° |
| C19 | C21 | C22 | H211 | 120.0° | 120.0° |
| C19 | C21 | C22 | O30 | 97.4° | 55.0° |
| C19 | C21 | C22 | C23 | 142.7° | 174.9° |
| C19 | C21 | C22 | H221 | 24.1° | 65.0° |
| C21 | C19 | N18 | H181 | 0.5° | 0.0° |
| C19 | C21 | N31 | H311 | 180.0° | 63.9° |
| C19 | C21 | N31 | H1 | 60.0° | 60.0° |
| C21 | C22 | O30 | C23 | 119.7° | 120.0° |
| C21 | C22 | O30 | H221 | 120.1° | 120.0° |
| C21 | C22 | C23 | H221 | 118.8° | 120.0° |
| C21 | C22 | C23 | C24 | 75.3° | 175.0° |
| C21 | C22 | C23 | O29 | 165.0° | 55.0° |
| C21 | C22 | C23 | H231 | 43.8° | 65.0° |
| C22 | C21 | N31 | H311 | 59.9° | 176.1° |
| C22 | C21 | N31 | H1 | 179.9° | 60.0° |
| C21 | C22 | O30 | H301 | 180.0° | 60.1° |
| O30 | C22 | C23 | H221 | 121.7° | 120.0° |
| O30 | C22 | C23 | C24 | 165.2° | 55.1° |
| O30 | C22 | C23 | O29 | 45.5° | 65.0° |
| O30 | C22 | C21 | H211 | 142.6° | 175.0° |
| O30 | C22 | C23 | H231 | 75.7° | 175.0° |
| C22 | C23 | C24 | O29 | 120.0° | 120.1° |
| C22 | C23 | C24 | H231 | 118.9° | 120.0° |
| C22 | C23 | O29 | H231 | 119.7° | 120.0° |
| C22 | C23 | C24 | O25 | 115.1° | 175.0° |
| C23 | C22 | C21 | H211 | 22.7° | 65.0° |
| C22 | C23 | C24 | H241 | 4.7° | 65.0° |
| C22 | C23 | C24 | H242 | 125.1° | 54.9° |
| C22 | C23 | O29 | H291 | 180.0° | 59.9° |
| C23 | C22 | O30 | H301 | 60.3° | 59.9° |
| C24 | C23 | O29 | H231 | 119.8° | 120.0° |
| C23 | C24 | O25 | H241 | 119.8° | 120.0° |
| C23 | C24 | O25 | H242 | 119.8° | 120.0° |
| C23 | C24 | O25 | C26 | 156.7° | 180.0° |
| C24 | C23 | C22 | H221 | 43.5° | 64.9° |
| C23 | C24 | H241 | H242 | 120.6° | 120.0° |
| C24 | C23 | O29 | H291 | 59.6° | 60.1° |
| O29 | C23 | C24 | O25 | 4.9° | 65.0° |
| O29 | C23 | C22 | H221 | 76.2° | 175.0° |
| O29 | C23 | C24 | H241 | 124.7° | 55.0° |
| O29 | C23 | C24 | H242 | 114.9° | 175.0° |
| C24 | O25 | C26 | O27 | 48.1° | 0.1° |
| C24 | O25 | C26 | N28 | 131.8° | 180.0° |
| O25 | C24 | H241 | H242 | 120.6° | 120.0° |
| O25 | C24 | C23 | H231 | 126.0° | 55.0° |
| O27 | C26 | O25 | N28 | 180.0° | 180.0° |
| O27 | C26 | N28 | H281 | 0.0° | 179.9° |
| O27 | C26 | N28 | H282 | 180.0° | 0.0° |
| C26 | O25 | C24 | H241 | 36.8° | 60.0° |
| C26 | O25 | C24 | H242 | 83.6° | 60.0° |
| O25 | C26 | N28 | H281 | 180.0° | 0.1° |
| O25 | C26 | N28 | H282 | 0.1° | 180.0° |
| C26 | N28 | H281 | H282 | 180.0° | 179.9° |
| H101 | C10 | C09 | H091 | 156.0° | 160.3° |
| H101 | C10 | C11 | H111 | 31.0° | 21.3° |
| H101 | C10 | O33 | H331 | 54.2° | 62.1° |
| H211 | C21 | C22 | H221 | 96.0° | 55.0° |
| H211 | C21 | N31 | H311 | 59.9° | 56.1° |
| H211 | C21 | N31 | H1 | 60.1° | 180.0° |
| H221 | C22 | C23 | H231 | 162.6° | 55.0° |
| H221 | C22 | O30 | H301 | 59.9° | 180.0° |
| H241 | C24 | C23 | H231 | 114.2° | 175.0° |
| H242 | C24 | C23 | H231 | 6.2° | 65.0° |
| H111 | C11 | C12 | H121 | 98.7° | 123.8° |
| H111 | C11 | O32 | H321 | 57.0° | 61.2° |
| H121 | C12 | C14 | H141 | 175.9° | 66.0° |
| H141 | C14 | N18 | H181 | 0.1° | 145.0° |
| H231 | C23 | O29 | H291 | 60.3° | 179.9° |
