JQG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C26 | sing | 1.53Å | 1.54Å | |
| C28 | C26 | sing | 1.53Å | 1.52Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C25 | N29 | sing | 1.47Å | 1.45Å | |
| C25 | C02 | sing | 1.51Å | 1.53Å | |
| N29 | C30 | sing | 1.35Å | 1.46Å | |
| C30 | O31 | doub | 1.21Å | 1.19Å | |
| C02 | O01 | doub | 1.21Å | 1.18Å | |
| C02 | N03 | sing | 1.35Å | 1.46Å | |
| N03 | C04 | sing | 1.46Å | 1.45Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C05 | N06 | sing | 1.46Å | 1.46Å | |
| N06 | C07 | sing | 1.35Å | 1.46Å | |
| O24 | C07 | doub | 1.21Å | 1.18Å | |
| C07 | C08 | sing | 1.51Å | 1.54Å | |
| C08 | C09 | sing | 1.53Å | 1.54Å | |
| C09 | N10 | sing | 1.47Å | 1.46Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| O23 | C11 | doub | 1.21Å | 1.18Å | |
| C22 | C14 | sing | 1.53Å | 1.52Å | |
| N10 | C11 | sing | 1.35Å | 1.46Å | |
| C11 | C12 | sing | 1.51Å | 1.53Å | |
| C14 | C12 | sing | 1.53Å | 1.53Å | |
| C14 | C16 | sing | 1.53Å | 1.52Å | |
| C12 | O13 | sing | 1.43Å | 1.40Å | |
| C16 | O17 | sing | 1.43Å | 1.40Å | |
| O17 | P18 | sing | 1.61Å | 1.64Å | |
| O21 | P18 | doub | 1.48Å | 1.51Å | |
| P18 | O19 | doub | 1.48Å | 1.51Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C04 | H042 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C15 | H153 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C22 | H223 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C27 | H273 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C28 | H283 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| N03 | H031 | sing | 0.97Å | 1.00Å | |
| N06 | H061 | sing | 0.97Å | 1.00Å | |
| N10 | H101 | sing | 0.97Å | 1.00Å | |
| N29 | H291 | sing | 0.97Å | 1.00Å | |
| O13 | H131 | sing | 0.97Å | 0.95Å | |
| P18 | O1 | sing | 1.61Å | 1.64Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | C26 | C28 | 111.3° | 109.5° |
| C27 | C26 | C25 | 109.9° | 109.5° |
| C27 | C26 | H261 | 107.0° | 109.5° |
| C26 | C27 | H273 | 109.5° | 109.5° |
| C26 | C27 | H272 | 109.5° | 109.5° |
| C26 | C27 | H271 | 109.4° | 109.5° |
| C28 | C26 | C25 | 113.8° | 109.5° |
| C28 | C26 | H261 | 107.3° | 109.4° |
| C26 | C28 | H283 | 109.5° | 109.5° |
| C26 | C28 | H282 | 109.5° | 109.5° |
| C26 | C28 | H281 | 109.5° | 109.5° |
| C26 | C25 | N29 | 110.6° | 109.5° |
| C26 | C25 | C02 | 112.9° | 109.5° |
| C26 | C25 | H251 | 108.5° | 109.5° |
| C25 | C26 | H261 | 107.1° | 109.4° |
| N29 | C25 | C02 | 106.6° | 109.4° |
| C25 | N29 | C30 | 119.4° | 120.0° |
| N29 | C25 | H251 | 109.6° | 109.5° |
| C25 | N29 | H291 | 120.3° | 120.0° |
| C25 | C02 | O01 | 120.9° | 120.1° |
| C25 | C02 | N03 | 118.6° | 120.0° |
| C02 | C25 | H251 | 108.6° | 109.5° |
| N29 | C30 | O31 | 120.0° | 120.0° |
| N29 | C30 | H301 | 120.1° | 120.0° |
| C30 | N29 | H291 | 120.3° | 120.0° |
| O31 | C30 | H301 | 120.0° | 120.0° |
| O01 | C02 | N03 | 120.4° | 120.0° |
| C02 | N03 | C04 | 119.9° | 120.0° |
| C02 | N03 | H031 | 120.1° | 120.0° |
| N03 | C04 | C05 | 107.5° | 109.5° |
| N03 | C04 | H041 | 110.0° | 109.5° |
| N03 | C04 | H042 | 110.0° | 109.5° |
| C04 | N03 | H031 | 120.1° | 120.0° |
| C04 | C05 | N06 | 108.0° | 109.5° |
| C05 | C04 | H041 | 109.9° | 109.5° |
| C05 | C04 | H042 | 110.0° | 109.5° |
| C04 | C05 | H052 | 109.8° | 109.4° |
| C04 | C05 | H051 | 109.8° | 109.4° |
| C05 | N06 | C07 | 118.6° | 120.0° |
| N06 | C05 | H052 | 109.8° | 109.5° |
| N06 | C05 | H051 | 109.9° | 109.5° |
| C05 | N06 | H061 | 120.7° | 120.0° |
| N06 | C07 | O24 | 120.5° | 120.0° |
| N06 | C07 | C08 | 119.3° | 120.1° |
| C07 | N06 | H061 | 120.7° | 119.9° |
| O24 | C07 | C08 | 120.2° | 119.9° |
| C07 | C08 | C09 | 110.0° | 109.5° |
| C07 | C08 | H081 | 109.3° | 109.4° |
| C07 | C08 | H082 | 109.3° | 109.4° |
| C08 | C09 | N10 | 109.8° | 109.5° |
| C09 | C08 | H081 | 109.3° | 109.5° |
| C09 | C08 | H082 | 109.3° | 109.5° |
| C08 | C09 | H092 | 109.4° | 109.5° |
| C08 | C09 | H091 | 109.4° | 109.5° |
| C09 | N10 | C11 | 119.8° | 120.0° |
| N10 | C09 | H092 | 109.4° | 109.5° |
| N10 | C09 | H091 | 109.4° | 109.4° |
| C09 | N10 | H101 | 120.1° | 120.0° |
| C15 | C14 | C22 | 108.2° | 109.4° |
| C15 | C14 | C12 | 110.9° | 109.5° |
| C15 | C14 | C16 | 109.7° | 109.5° |
| C14 | C15 | H153 | 109.5° | 109.5° |
| C14 | C15 | H152 | 109.5° | 109.5° |
| C14 | C15 | H151 | 109.5° | 109.4° |
| O23 | C11 | N10 | 120.3° | 120.0° |
| O23 | C11 | C12 | 120.5° | 120.0° |
| C22 | C14 | C12 | 109.5° | 109.5° |
| C22 | C14 | C16 | 109.5° | 109.5° |
| C14 | C22 | H223 | 109.5° | 109.5° |
| C14 | C22 | H222 | 109.4° | 109.5° |
| C14 | C22 | H221 | 109.5° | 109.4° |
| N10 | C11 | C12 | 119.2° | 120.0° |
| C11 | N10 | H101 | 120.1° | 120.0° |
| C11 | C12 | C14 | 110.9° | 109.5° |
| C11 | C12 | O13 | 108.9° | 109.4° |
| C11 | C12 | H121 | 108.7° | 109.4° |
| C12 | C14 | C16 | 109.0° | 109.5° |
| C14 | C12 | O13 | 109.0° | 109.5° |
| C14 | C12 | H121 | 108.8° | 109.5° |
| C14 | C16 | O17 | 109.3° | 109.5° |
| C14 | C16 | H162 | 109.5° | 109.4° |
| C14 | C16 | H161 | 109.5° | 109.5° |
| O13 | C12 | H121 | 110.6° | 109.5° |
| C12 | O13 | H131 | 109.5° | 114.0° |
| C16 | O17 | P18 | 119.3° | 123.0° |
| O17 | C16 | H162 | 109.5° | 109.4° |
| O17 | C16 | H161 | 109.5° | 109.5° |
| O17 | P18 | O21 | 111.7° | 109.5° |
| O17 | P18 | O19 | 108.8° | 109.5° |
| O17 | P18 | O1 | 102.4° | 109.5° |
| O21 | P18 | O19 | 109.3° | 109.5° |
| O21 | P18 | O1 | 110.5° | 109.4° |
| O19 | P18 | O1 | 114.0° | 109.4° |
| H041 | C04 | H042 | 109.5° | 109.5° |
| H052 | C05 | H051 | 109.5° | 109.5° |
| H081 | C08 | H082 | 109.5° | 109.5° |
| H092 | C09 | H091 | 109.5° | 109.5° |
| H153 | C15 | H152 | 109.5° | 109.4° |
| H153 | C15 | H151 | 109.5° | 109.6° |
| H152 | C15 | H151 | 109.4° | 109.5° |
| H162 | C16 | H161 | 109.5° | 109.5° |
| H223 | C22 | H222 | 109.5° | 109.5° |
| H223 | C22 | H221 | 109.4° | 109.4° |
| H222 | C22 | H221 | 109.5° | 109.4° |
| H273 | C27 | H272 | 109.5° | 109.5° |
| H273 | C27 | H271 | 109.5° | 109.4° |
| H272 | C27 | H271 | 109.5° | 109.4° |
| H283 | C28 | H282 | 109.5° | 109.5° |
| H283 | C28 | H281 | 109.5° | 109.4° |
| H282 | C28 | H281 | 109.4° | 109.5° |
| P18 | O1 | H1 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | C26 | C28 | C25 | 124.9° | 120.0° |
| C27 | C26 | C28 | H261 | 116.8° | 120.0° |
| C27 | C26 | C25 | H261 | 116.0° | 120.1° |
| C27 | C26 | C25 | N29 | 142.1° | 65.8° |
| C27 | C26 | C25 | C02 | 98.5° | 174.3° |
| C27 | C26 | C25 | H251 | 21.9° | 54.2° |
| C26 | C27 | H273 | H272 | 120.0° | 120.1° |
| C26 | C27 | H273 | H271 | 120.0° | 120.0° |
| C26 | C27 | H272 | H271 | 120.0° | 120.0° |
| C27 | C26 | C28 | H283 | 180.0° | 180.0° |
| C27 | C26 | C28 | H282 | 60.0° | 60.0° |
| C27 | C26 | C28 | H281 | 60.0° | 60.0° |
| C28 | C26 | C25 | H261 | 118.4° | 119.9° |
| C28 | C26 | C25 | N29 | 92.3° | 54.2° |
| C28 | C26 | C25 | C02 | 27.1° | 65.7° |
| C28 | C26 | C25 | H251 | 147.5° | 174.2° |
| C28 | C26 | C27 | H273 | 180.0° | 52.4° |
| C28 | C26 | C27 | H272 | 60.0° | 67.6° |
| C28 | C26 | C27 | H271 | 60.0° | 172.4° |
| C26 | C28 | H283 | H282 | 120.0° | 120.0° |
| C26 | C28 | H283 | H281 | 120.0° | 120.0° |
| C26 | C28 | H282 | H281 | 120.0° | 120.0° |
| C26 | C25 | N29 | C02 | 123.1° | 120.0° |
| C26 | C25 | N29 | H251 | 119.6° | 120.0° |
| C26 | C25 | C02 | H251 | 120.3° | 120.1° |
| C26 | C25 | N29 | C30 | 148.3° | 85.0° |
| C26 | C25 | C02 | O01 | 82.7° | 101.0° |
| C26 | C25 | C02 | N03 | 98.5° | 78.7° |
| C25 | C26 | C27 | H273 | 53.0° | 67.6° |
| C25 | C26 | C27 | H272 | 173.0° | 172.4° |
| C25 | C26 | C27 | H271 | 67.0° | 52.4° |
| C25 | C26 | C28 | H283 | 55.1° | 60.0° |
| C25 | C26 | C28 | H282 | 64.9° | 180.0° |
| C25 | C26 | C28 | H281 | 175.2° | 60.0° |
| C26 | C25 | N29 | H291 | 31.8° | 95.0° |
| N29 | C25 | C02 | H251 | 118.0° | 120.0° |
| C25 | N29 | C30 | H291 | 180.0° | 180.0° |
| C25 | N29 | C30 | O31 | 0.5° | 0.0° |
| N29 | C25 | C02 | O01 | 38.9° | 19.0° |
| N29 | C25 | C02 | N03 | 139.8° | 161.3° |
| N29 | C25 | C26 | H261 | 26.2° | 174.2° |
| C25 | N29 | C30 | H301 | 179.5° | 180.0° |
| C02 | C25 | N29 | C30 | 88.7° | 155.0° |
| C25 | C02 | O01 | N03 | 178.7° | 179.7° |
| C25 | C02 | N03 | C04 | 179.3° | 174.7° |
| C02 | C25 | C26 | H261 | 145.6° | 54.2° |
| C25 | C02 | N03 | H031 | 0.7° | 5.3° |
| C02 | C25 | N29 | H291 | 91.3° | 25.0° |
| N29 | C30 | O31 | H301 | 180.0° | 180.0° |
| C30 | N29 | C25 | H251 | 28.7° | 35.0° |
| O31 | C30 | N29 | H291 | 179.5° | 180.0° |
| O01 | C02 | N03 | C04 | 0.6° | 5.0° |
| O01 | C02 | C25 | H251 | 157.0° | 138.9° |
| O01 | C02 | N03 | H031 | 179.4° | 175.0° |
| C02 | N03 | C04 | H031 | 180.0° | 179.9° |
| C02 | N03 | C04 | C05 | 141.4° | 180.0° |
| C02 | N03 | C04 | H041 | 99.0° | 60.0° |
| C02 | N03 | C04 | H042 | 21.6° | 60.0° |
| N03 | C02 | C25 | H251 | 21.8° | 41.4° |
| N03 | C04 | C05 | H041 | 119.7° | 120.0° |
| N03 | C04 | C05 | H042 | 119.7° | 120.0° |
| N03 | C04 | C05 | N06 | 166.5° | 180.0° |
| N03 | C04 | H041 | H042 | 120.9° | 120.0° |
| N03 | C04 | C05 | H052 | 73.8° | 60.0° |
| N03 | C04 | C05 | H051 | 46.7° | 60.0° |
| C04 | C05 | N06 | H052 | 119.8° | 119.9° |
| C04 | C05 | N06 | H051 | 119.8° | 120.0° |
| C04 | C05 | N06 | C07 | 64.9° | 180.0° |
| C05 | C04 | H041 | H042 | 120.9° | 120.0° |
| C04 | C05 | H052 | H051 | 120.6° | 119.9° |
| C05 | C04 | N03 | H031 | 38.6° | 0.1° |
| C04 | C05 | N06 | H061 | 115.1° | 0.1° |
| C05 | N06 | C07 | H061 | 180.0° | 179.9° |
| C05 | N06 | C07 | O24 | 1.1° | 0.1° |
| C05 | N06 | C07 | C08 | 179.6° | 180.0° |
| N06 | C05 | C04 | H041 | 46.8° | 60.0° |
| N06 | C05 | C04 | H042 | 73.8° | 60.0° |
| N06 | C05 | H052 | H051 | 120.7° | 120.1° |
| N06 | C07 | O24 | C08 | 179.3° | 179.9° |
| N06 | C07 | C08 | C09 | 108.9° | 180.0° |
| C07 | N06 | C05 | H052 | 54.9° | 60.1° |
| C07 | N06 | C05 | H051 | 175.3° | 60.0° |
| N06 | C07 | C08 | H081 | 11.2° | 60.0° |
| N06 | C07 | C08 | H082 | 131.0° | 60.0° |
| O24 | C07 | C08 | C09 | 70.4° | 0.0° |
| O24 | C07 | C08 | H081 | 169.5° | 120.1° |
| O24 | C07 | C08 | H082 | 49.7° | 120.0° |
| O24 | C07 | N06 | H061 | 178.9° | 180.0° |
| C07 | C08 | C09 | H081 | 120.1° | 120.0° |
| C07 | C08 | C09 | H082 | 120.1° | 120.0° |
| C07 | C08 | C09 | N10 | 152.3° | 180.0° |
| C07 | C08 | H081 | H082 | 119.8° | 119.9° |
| C07 | C08 | C09 | H092 | 87.7° | 60.0° |
| C07 | C08 | C09 | H091 | 32.3° | 60.0° |
| C08 | C07 | N06 | H061 | 0.4° | 0.1° |
| C08 | C09 | N10 | H092 | 120.1° | 120.0° |
| C08 | C09 | N10 | H091 | 120.0° | 120.0° |
| C08 | C09 | N10 | C11 | 75.5° | 180.0° |
| C09 | C08 | H081 | H082 | 119.8° | 120.0° |
| C08 | C09 | H092 | H091 | 119.9° | 120.0° |
| C08 | C09 | N10 | H101 | 104.5° | 0.1° |
| C09 | N10 | C11 | O23 | 0.4° | 4.9° |
| C09 | N10 | C11 | H101 | 180.0° | 179.9° |
| C09 | N10 | C11 | C12 | 179.8° | 175.1° |
| N10 | C09 | C08 | H081 | 32.2° | 60.0° |
| N10 | C09 | C08 | H082 | 87.7° | 60.0° |
| N10 | C09 | H092 | H091 | 119.8° | 120.0° |
| C15 | C14 | C22 | C12 | 120.9° | 120.0° |
| C15 | C14 | C22 | C16 | 119.6° | 120.0° |
| C15 | C14 | C12 | C11 | 45.7° | 63.9° |
| C15 | C14 | C12 | C16 | 120.9° | 120.0° |
| C15 | C14 | C12 | O13 | 165.5° | 176.1° |
| C15 | C14 | C16 | O17 | 69.9° | 59.9° |
| C15 | C14 | C12 | H121 | 73.8° | 56.0° |
| C14 | C15 | H153 | H152 | 120.0° | 119.9° |
| C14 | C15 | H153 | H151 | 120.0° | 120.0° |
| C14 | C15 | H152 | H151 | 120.0° | 120.0° |
| C15 | C14 | C16 | H162 | 50.1° | 60.0° |
| C15 | C14 | C16 | H161 | 170.1° | 180.0° |
| C15 | C14 | C22 | H223 | 180.0° | 56.4° |
| C15 | C14 | C22 | H222 | 60.0° | 63.7° |
| C15 | C14 | C22 | H221 | 60.0° | 176.4° |
| O23 | C11 | N10 | C12 | 179.5° | 180.0° |
| O23 | C11 | C12 | C14 | 94.6° | 105.6° |
| O23 | C11 | C12 | O13 | 25.2° | 14.5° |
| O23 | C11 | C12 | H121 | 145.9° | 134.4° |
| O23 | C11 | N10 | H101 | 179.6° | 175.0° |
| C22 | C14 | C12 | C11 | 73.7° | 176.1° |
| C22 | C14 | C12 | C16 | 119.8° | 120.0° |
| C22 | C14 | C12 | O13 | 46.2° | 56.1° |
| C22 | C14 | C16 | O17 | 171.4° | 60.0° |
| C22 | C14 | C12 | H121 | 166.8° | 63.9° |
| C22 | C14 | C15 | H153 | 180.0° | 175.1° |
| C22 | C14 | C15 | H152 | 60.0° | 55.2° |
| C22 | C14 | C15 | H151 | 60.0° | 64.8° |
| C22 | C14 | C16 | H162 | 68.6° | 179.9° |
| C22 | C14 | C16 | H161 | 51.4° | 60.1° |
| C14 | C22 | H223 | H222 | 120.0° | 120.1° |
| C14 | C22 | H223 | H221 | 120.0° | 120.0° |
| C14 | C22 | H222 | H221 | 120.0° | 120.0° |
| N10 | C11 | C12 | C14 | 85.9° | 74.5° |
| N10 | C11 | C12 | O13 | 154.2° | 165.5° |
| C11 | N10 | C09 | H092 | 44.5° | 59.9° |
| C11 | N10 | C09 | H091 | 164.4° | 60.0° |
| N10 | C11 | C12 | H121 | 33.6° | 45.5° |
| C11 | C12 | C14 | O13 | 119.9° | 120.0° |
| C11 | C12 | C14 | H121 | 119.5° | 120.0° |
| C11 | C12 | C14 | C16 | 166.5° | 56.1° |
| C11 | C12 | O13 | H121 | 119.4° | 119.9° |
| C12 | C11 | N10 | H101 | 0.1° | 5.0° |
| C11 | C12 | O13 | H131 | 10.6° | 60.1° |
| C14 | C12 | O13 | H121 | 119.5° | 120.0° |
| C12 | C14 | C16 | O17 | 51.6° | 180.0° |
| C12 | C14 | C15 | H153 | 59.9° | 64.9° |
| C12 | C14 | C15 | H152 | 60.1° | 175.2° |
| C12 | C14 | C15 | H151 | 179.9° | 55.2° |
| C12 | C14 | C16 | H162 | 171.6° | 60.0° |
| C12 | C14 | C16 | H161 | 68.4° | 60.0° |
| C12 | C14 | C22 | H223 | 59.0° | 63.6° |
| C12 | C14 | C22 | H222 | 179.0° | 176.3° |
| C12 | C14 | C22 | H221 | 61.0° | 56.4° |
| C14 | C12 | O13 | H131 | 110.4° | 59.9° |
| C16 | C14 | C12 | O13 | 73.6° | 63.9° |
| C14 | C16 | O17 | H162 | 120.0° | 119.9° |
| C14 | C16 | O17 | H161 | 120.0° | 120.1° |
| C14 | C16 | O17 | P18 | 164.6° | 180.0° |
| C16 | C14 | C12 | H121 | 47.1° | 176.1° |
| C16 | C14 | C15 | H153 | 60.6° | 55.1° |
| C16 | C14 | C15 | H152 | 179.4° | 64.8° |
| C16 | C14 | C15 | H151 | 59.5° | 175.2° |
| C14 | C16 | H162 | H161 | 120.0° | 120.0° |
| C16 | C14 | C22 | H223 | 60.4° | 176.4° |
| C16 | C14 | C22 | H222 | 59.6° | 56.3° |
| C16 | C14 | C22 | H221 | 179.6° | 63.7° |
| C16 | O17 | P18 | O21 | 36.6° | 45.0° |
| C16 | O17 | P18 | O19 | 157.3° | 75.1° |
| O17 | C16 | H162 | H161 | 120.1° | 120.0° |
| C16 | O17 | P18 | O1 | 81.7° | 165.0° |
| O17 | P18 | O21 | O19 | 120.5° | 120.1° |
| O17 | P18 | O21 | O1 | 113.3° | 120.0° |
| O17 | P18 | O19 | O1 | 113.6° | 120.0° |
| P18 | O17 | C16 | H162 | 75.5° | 60.1° |
| P18 | O17 | C16 | H161 | 44.6° | 59.9° |
| O17 | P18 | O1 | H1 | 119.1° | 180.0° |
| O21 | P18 | O19 | O1 | 124.2° | 119.9° |
| O21 | P18 | O1 | H1 | 0.0° | 60.0° |
| O19 | P18 | O1 | H1 | 123.5° | 60.0° |
| H041 | C04 | C05 | H052 | 166.5° | 60.0° |
| H041 | C04 | C05 | H051 | 73.0° | 180.0° |
| H041 | C04 | N03 | H031 | 81.0° | 120.0° |
| H042 | C04 | C05 | H052 | 45.9° | 180.0° |
| H042 | C04 | C05 | H051 | 166.4° | 60.0° |
| H042 | C04 | N03 | H031 | 158.4° | 120.0° |
| H052 | C05 | N06 | H061 | 125.1° | 120.0° |
| H051 | C05 | N06 | H061 | 4.6° | 119.9° |
| H081 | C08 | C09 | H092 | 152.2° | 180.0° |
| H081 | C08 | C09 | H091 | 87.8° | 60.0° |
| H082 | C08 | C09 | H092 | 32.4° | 60.0° |
| H082 | C08 | C09 | H091 | 152.3° | 180.0° |
| H092 | C09 | N10 | H101 | 135.4° | 120.0° |
| H091 | C09 | N10 | H101 | 15.5° | 120.0° |
| H121 | C12 | O13 | H131 | 130.1° | 180.0° |
| H153 | C15 | H152 | H151 | 120.0° | 120.1° |
| H223 | C22 | H222 | H221 | 119.9° | 119.9° |
| H251 | C25 | C26 | H261 | 94.1° | 65.9° |
| H251 | C25 | N29 | H291 | 151.4° | 145.0° |
| H261 | C26 | C27 | H273 | 63.0° | 172.4° |
| H261 | C26 | C27 | H272 | 57.0° | 52.4° |
| H261 | C26 | C27 | H271 | 177.0° | 67.6° |
| H261 | C26 | C28 | H283 | 63.2° | 60.0° |
| H261 | C26 | C28 | H282 | 176.8° | 60.0° |
| H261 | C26 | C28 | H281 | 56.9° | 180.0° |
| H273 | C27 | H272 | H271 | 120.0° | 119.9° |
| H283 | C28 | H282 | H281 | 120.0° | 120.0° |
| H301 | C30 | N29 | H291 | 0.5° | 0.0° |
