XTP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C18 | C16 | sing | 1.53Å | 1.54Å | |
| C27 | C28 | doub | 1.38Å | 1.33Å | Aromatic |
| C27 | C26 | sing | 1.38Å | 1.54Å | Aromatic |
| C28 | C23 | sing | 1.38Å | 1.54Å | Aromatic |
| O21 | C22 | sing | 1.45Å | 1.43Å | |
| O21 | C20 | sing | 1.35Å | 1.41Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| C15 | C14 | sing | 1.53Å | 1.51Å | |
| N19 | C20 | sing | 1.35Å | 1.47Å | |
| N19 | C14 | sing | 1.46Å | 1.43Å | |
| C17 | C16 | sing | 1.53Å | 1.50Å | |
| C26 | C25 | doub | 1.38Å | 1.32Å | Aromatic |
| O01 | C02 | doub | 1.21Å | 1.18Å | |
| C23 | C22 | sing | 1.51Å | 1.57Å | |
| C23 | C24 | doub | 1.38Å | 1.33Å | Aromatic |
| C20 | O29 | doub | 1.21Å | 1.21Å | |
| C25 | C24 | sing | 1.38Å | 1.54Å | Aromatic |
| C14 | C02 | sing | 1.51Å | 1.52Å | |
| C02 | N03 | sing | 1.35Å | 1.45Å | |
| N03 | C04 | sing | 1.47Å | 1.46Å | |
| C07 | C08 | sing | 1.54Å | 1.54Å | |
| C07 | C06 | sing | 1.55Å | 1.49Å | |
| C04 | C12 | sing | 1.53Å | 1.54Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C08 | N09 | sing | 1.47Å | 1.51Å | |
| C12 | O13 | sing | 1.43Å | 1.21Å | |
| C06 | C05 | sing | 1.53Å | 1.57Å | |
| C06 | C10 | sing | 1.51Å | 1.51Å | |
| N09 | C10 | sing | 1.34Å | 1.48Å | |
| C10 | O11 | doub | 1.21Å | 1.18Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C28 | H281 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.09Å | 1.10Å | |
| C05 | H052 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.09Å | 1.10Å | |
| C07 | H071 | sing | 1.09Å | 1.10Å | |
| C07 | H072 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| N03 | H031 | sing | 0.97Å | 1.00Å | |
| N09 | H091 | sing | 0.97Å | 1.00Å | |
| N19 | H191 | sing | 0.97Å | 1.00Å | |
| C12 | H1 | sing | 1.09Å | 1.10Å | |
| O13 | H2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C18 | C16 | 58.6° | 60.0° |
| C18 | C17 | C16 | 60.9° | 60.0° |
| C18 | C17 | H172 | 119.9° | 117.5° |
| C18 | C17 | H171 | 119.8° | 117.5° |
| C17 | C18 | H181 | 120.2° | 117.5° |
| C17 | C18 | H182 | 120.2° | 117.5° |
| C18 | C16 | C15 | 114.5° | 117.5° |
| C18 | C16 | C17 | 60.5° | 60.0° |
| C18 | C16 | H161 | 117.9° | 117.6° |
| C16 | C18 | H181 | 120.3° | 117.5° |
| C16 | C18 | H182 | 120.3° | 117.5° |
| C28 | C27 | C26 | 120.4° | 120.0° |
| C27 | C28 | C23 | 120.5° | 120.0° |
| C27 | C28 | H281 | 119.7° | 120.0° |
| C28 | C27 | H271 | 119.8° | 120.0° |
| C27 | C26 | C25 | 119.5° | 120.0° |
| C27 | C26 | H261 | 120.2° | 120.0° |
| C26 | C27 | H271 | 119.8° | 120.0° |
| C28 | C23 | C22 | 121.4° | 120.0° |
| C28 | C23 | C24 | 118.3° | 120.0° |
| C23 | C28 | H281 | 119.7° | 120.0° |
| C22 | O21 | C20 | 112.5° | 117.0° |
| O21 | C22 | C23 | 110.9° | 109.5° |
| O21 | C22 | H221 | 109.1° | 109.4° |
| O21 | C22 | H222 | 109.1° | 109.5° |
| O21 | C20 | N19 | 116.2° | 120.0° |
| O21 | C20 | O29 | 121.1° | 120.0° |
| C16 | C15 | C14 | 107.6° | 109.4° |
| C15 | C16 | C17 | 114.6° | 117.5° |
| C16 | C15 | H151 | 110.0° | 109.5° |
| C16 | C15 | H152 | 110.0° | 109.4° |
| C15 | C16 | H161 | 118.0° | 115.5° |
| C15 | C14 | N19 | 106.5° | 109.5° |
| C15 | C14 | C02 | 111.4° | 109.5° |
| C14 | C15 | H151 | 109.9° | 109.5° |
| C14 | C15 | H152 | 109.9° | 109.5° |
| C15 | C14 | H141 | 109.5° | 109.5° |
| C20 | N19 | C14 | 122.0° | 120.0° |
| N19 | C20 | O29 | 122.7° | 120.0° |
| C20 | N19 | H191 | 119.0° | 120.0° |
| N19 | C14 | C02 | 109.3° | 109.5° |
| N19 | C14 | H141 | 110.7° | 109.5° |
| C14 | N19 | H191 | 119.0° | 120.0° |
| C16 | C17 | H172 | 119.9° | 117.5° |
| C16 | C17 | H171 | 119.8° | 117.6° |
| C17 | C16 | H161 | 118.6° | 117.5° |
| C26 | C25 | C24 | 119.9° | 120.0° |
| C25 | C26 | H261 | 120.3° | 120.0° |
| C26 | C25 | H251 | 120.0° | 120.0° |
| O01 | C02 | C14 | 122.7° | 120.0° |
| O01 | C02 | N03 | 118.6° | 120.0° |
| C22 | C23 | C24 | 120.3° | 120.0° |
| C23 | C22 | H221 | 109.1° | 109.5° |
| C23 | C22 | H222 | 109.1° | 109.5° |
| C23 | C24 | C25 | 121.3° | 120.0° |
| C23 | C24 | H241 | 119.3° | 120.0° |
| C25 | C24 | H241 | 119.4° | 120.0° |
| C24 | C25 | H251 | 120.0° | 120.0° |
| C14 | C02 | N03 | 118.7° | 120.0° |
| C02 | C14 | H141 | 109.4° | 109.4° |
| C02 | N03 | C04 | 121.7° | 120.0° |
| C02 | N03 | H031 | 119.1° | 120.0° |
| N03 | C04 | C12 | 109.4° | 109.4° |
| N03 | C04 | C05 | 103.5° | 109.5° |
| N03 | C04 | H041 | 109.7° | 109.5° |
| C04 | N03 | H031 | 119.2° | 120.0° |
| C08 | C07 | C06 | 104.6° | 101.7° |
| C07 | C08 | N09 | 106.1° | 105.5° |
| C08 | C07 | H071 | 110.7° | 110.9° |
| C08 | C07 | H072 | 110.7° | 111.0° |
| C07 | C08 | H082 | 110.3° | 110.2° |
| C07 | C08 | H081 | 110.3° | 110.2° |
| C07 | C06 | C05 | 109.4° | 110.5° |
| C07 | C06 | C10 | 105.6° | 104.2° |
| C07 | C06 | H061 | 109.6° | 110.6° |
| C06 | C07 | H071 | 110.7° | 110.8° |
| C06 | C07 | H072 | 110.7° | 111.2° |
| C12 | C04 | C05 | 116.7° | 109.5° |
| C04 | C12 | O13 | 118.5° | 109.5° |
| C12 | C04 | H041 | 108.7° | 109.4° |
| C04 | C12 | H121 | 107.2° | 109.5° |
| C04 | C12 | H1 | 107.2° | 109.5° |
| C04 | C05 | C06 | 111.0° | 109.5° |
| C05 | C04 | H041 | 108.7° | 109.5° |
| C04 | C05 | H052 | 109.1° | 109.5° |
| C04 | C05 | H051 | 109.1° | 109.5° |
| C08 | N09 | C10 | 106.4° | 111.3° |
| N09 | C08 | H082 | 110.3° | 110.4° |
| N09 | C08 | H081 | 110.3° | 110.0° |
| C08 | N09 | H091 | 126.8° | 124.3° |
| O13 | C12 | H121 | 107.2° | 109.4° |
| O13 | C12 | H1 | 107.2° | 109.5° |
| C12 | O13 | H2 | 109.5° | 114.0° |
| C05 | C06 | C10 | 114.1° | 110.5° |
| C06 | C05 | H052 | 109.1° | 109.4° |
| C06 | C05 | H051 | 109.1° | 109.5° |
| C05 | C06 | H061 | 108.7° | 110.4° |
| C06 | C10 | N09 | 109.0° | 110.1° |
| C06 | C10 | O11 | 128.3° | 124.9° |
| C10 | C06 | H061 | 109.3° | 110.5° |
| N09 | C10 | O11 | 122.7° | 125.0° |
| C10 | N09 | H091 | 126.8° | 124.3° |
| H151 | C15 | H152 | 109.4° | 109.5° |
| H172 | C17 | H171 | 109.5° | 115.6° |
| H221 | C22 | H222 | 109.5° | 109.5° |
| H052 | C05 | H051 | 109.5° | 109.4° |
| H071 | C07 | H072 | 109.5° | 110.9° |
| H082 | C08 | H081 | 109.5° | 110.3° |
| H121 | C12 | H1 | 109.5° | 109.5° |
| H181 | C18 | H182 | 109.4° | 115.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C18 | C16 | H181 | 109.1° | 107.5° |
| C17 | C18 | C16 | H182 | 109.1° | 107.5° |
| C18 | C17 | C16 | C15 | 105.4° | 107.5° |
| C18 | C17 | C16 | H172 | 109.7° | 107.4° |
| C18 | C17 | C16 | H171 | 109.7° | 107.5° |
| C18 | C17 | H172 | H171 | 144.3° | 145.7° |
| C17 | C18 | C16 | H161 | 108.8° | 107.5° |
| C17 | C18 | H181 | H182 | 145.5° | 145.7° |
| C18 | C16 | C15 | H161 | 145.6° | 145.8° |
| C18 | C16 | C15 | C14 | 149.7° | 115.2° |
| C18 | C16 | C15 | H151 | 90.6° | 124.7° |
| C18 | C16 | C15 | H152 | 30.0° | 4.7° |
| C16 | C18 | H181 | H182 | 145.5° | 145.7° |
| C28 | C27 | C26 | H271 | 180.0° | 179.7° |
| C27 | C28 | C23 | H281 | 180.0° | 180.0° |
| C28 | C27 | C26 | C25 | 0.4° | 0.2° |
| C27 | C28 | C23 | C22 | 178.6° | 180.0° |
| C27 | C28 | C23 | C24 | 0.0° | 0.0° |
| C28 | C27 | C26 | H261 | 179.6° | 179.7° |
| C26 | C27 | C28 | C23 | 0.0° | 0.2° |
| C27 | C26 | C25 | H261 | 180.0° | 179.9° |
| C27 | C26 | C25 | C24 | 0.7° | 0.1° |
| C26 | C27 | C28 | H281 | 180.0° | 179.8° |
| C27 | C26 | C25 | H251 | 179.3° | 180.0° |
| C28 | C23 | C22 | O21 | 4.5° | 90.0° |
| C28 | C23 | C22 | C24 | 178.5° | 180.0° |
| C28 | C23 | C24 | C25 | 0.4° | 0.3° |
| C28 | C23 | C22 | H221 | 115.7° | 150.0° |
| C28 | C23 | C22 | H222 | 124.7° | 30.0° |
| C28 | C23 | C24 | H241 | 179.6° | 180.0° |
| C23 | C28 | C27 | H271 | 180.0° | 180.0° |
| C22 | O21 | C20 | N19 | 172.6° | 180.0° |
| O21 | C22 | C23 | H221 | 120.2° | 119.9° |
| O21 | C22 | C23 | H222 | 120.2° | 120.0° |
| O21 | C22 | C23 | C24 | 176.9° | 90.0° |
| C22 | O21 | C20 | O29 | 6.2° | 0.1° |
| O21 | C22 | H221 | H222 | 119.3° | 120.0° |
| O21 | C20 | N19 | O29 | 178.7° | 179.9° |
| O21 | C20 | N19 | C14 | 171.7° | 175.3° |
| C20 | O21 | C22 | C23 | 86.2° | 180.0° |
| C20 | O21 | C22 | H221 | 153.6° | 60.0° |
| C20 | O21 | C22 | H222 | 34.0° | 60.0° |
| O21 | C20 | N19 | H191 | 8.3° | 4.7° |
| C16 | C15 | C14 | H151 | 119.7° | 120.0° |
| C16 | C15 | C14 | H152 | 119.7° | 119.9° |
| C16 | C15 | C14 | N19 | 106.9° | 65.7° |
| C15 | C16 | C17 | H161 | 146.9° | 144.9° |
| C16 | C15 | C14 | C02 | 134.0° | 174.3° |
| C16 | C15 | H151 | H152 | 120.9° | 120.0° |
| C15 | C16 | C17 | H172 | 4.3° | 145.0° |
| C15 | C16 | C17 | H171 | 144.9° | 0.0° |
| C16 | C15 | C14 | H141 | 12.8° | 54.4° |
| C15 | C16 | C18 | H181 | 145.4° | 145.0° |
| C15 | C16 | C18 | H182 | 3.6° | 0.1° |
| C15 | C14 | N19 | C20 | 175.7° | 156.2° |
| C15 | C14 | N19 | C02 | 120.4° | 120.0° |
| C15 | C14 | N19 | H141 | 119.0° | 120.0° |
| C14 | C15 | C16 | C17 | 82.5° | 176.1° |
| C15 | C14 | C02 | O01 | 70.0° | 120.0° |
| C15 | C14 | C02 | H141 | 121.2° | 120.0° |
| C15 | C14 | C02 | N03 | 109.8° | 60.0° |
| C14 | C15 | H151 | H152 | 120.8° | 120.0° |
| C14 | C15 | C16 | H161 | 64.6° | 30.5° |
| C15 | C14 | N19 | H191 | 4.3° | 23.8° |
| C20 | N19 | C14 | H191 | 180.0° | 180.0° |
| C20 | N19 | C14 | C02 | 63.9° | 83.8° |
| C20 | N19 | C14 | H141 | 56.7° | 36.1° |
| N19 | C14 | C02 | O01 | 47.4° | 0.0° |
| C14 | N19 | C20 | O29 | 7.1° | 4.8° |
| N19 | C14 | C02 | H141 | 121.4° | 120.0° |
| N19 | C14 | C02 | N03 | 132.8° | 180.0° |
| N19 | C14 | C15 | H151 | 133.3° | 54.4° |
| N19 | C14 | C15 | H152 | 12.8° | 174.4° |
| C17 | C16 | C15 | H151 | 157.9° | 56.1° |
| C17 | C16 | C15 | H152 | 37.3° | 63.9° |
| C16 | C17 | H172 | H171 | 144.3° | 145.8° |
| C26 | C25 | C24 | C23 | 0.8° | 0.3° |
| C26 | C25 | C24 | H251 | 180.0° | 179.9° |
| C26 | C25 | C24 | H241 | 179.2° | 179.9° |
| C25 | C26 | C27 | H271 | 179.6° | 179.9° |
| O01 | C02 | C14 | N03 | 179.8° | 179.9° |
| O01 | C02 | N03 | C04 | 0.6° | 0.1° |
| O01 | C02 | C14 | H141 | 168.8° | 120.0° |
| O01 | C02 | N03 | H031 | 179.4° | 180.0° |
| C22 | C23 | C24 | C25 | 179.0° | 179.7° |
| C23 | C22 | H221 | H222 | 119.4° | 120.1° |
| C22 | C23 | C24 | H241 | 1.1° | 0.0° |
| C22 | C23 | C28 | H281 | 1.4° | 0.0° |
| C23 | C24 | C25 | H241 | 180.0° | 179.7° |
| C24 | C23 | C22 | H221 | 62.8° | 30.0° |
| C24 | C23 | C22 | H222 | 56.7° | 150.0° |
| C24 | C23 | C28 | H281 | 180.0° | 180.0° |
| C23 | C24 | C25 | H251 | 179.2° | 179.8° |
| O29 | C20 | N19 | H191 | 172.9° | 175.2° |
| C24 | C25 | C26 | H261 | 179.2° | 180.0° |
| C14 | C02 | N03 | C04 | 179.2° | 180.0° |
| C02 | C14 | C15 | H151 | 14.2° | 65.6° |
| C02 | C14 | C15 | H152 | 106.3° | 54.4° |
| C14 | C02 | N03 | H031 | 0.8° | 0.1° |
| C02 | C14 | N19 | H191 | 116.1° | 96.2° |
| C02 | N03 | C04 | H031 | 180.0° | 179.9° |
| C02 | N03 | C04 | C12 | 108.0° | 83.1° |
| C02 | N03 | C04 | C05 | 127.0° | 156.9° |
| C02 | N03 | C04 | H041 | 11.1° | 36.8° |
| N03 | C02 | C14 | H141 | 11.4° | 60.0° |
| N03 | C04 | C12 | C05 | 117.0° | 120.0° |
| N03 | C04 | C12 | H041 | 119.8° | 120.0° |
| N03 | C04 | C05 | H041 | 116.6° | 120.1° |
| N03 | C04 | C12 | O13 | 176.6° | 65.0° |
| N03 | C04 | C05 | C06 | 72.2° | 63.8° |
| N03 | C04 | C05 | H052 | 48.0° | 56.2° |
| N03 | C04 | C05 | H051 | 167.6° | 176.2° |
| N03 | C04 | C12 | H121 | 55.3° | 55.0° |
| N03 | C04 | C12 | H1 | 62.1° | 175.0° |
| C08 | C07 | C06 | H071 | 119.2° | 118.0° |
| C08 | C07 | C06 | H072 | 119.2° | 118.2° |
| C07 | C08 | N09 | H082 | 119.5° | 119.1° |
| C07 | C08 | N09 | H081 | 119.5° | 118.9° |
| C08 | C07 | C06 | C05 | 150.8° | 143.5° |
| C08 | C07 | C06 | C10 | 27.6° | 24.8° |
| C07 | C08 | N09 | C10 | 17.4° | 16.6° |
| C08 | C07 | C06 | H061 | 90.1° | 94.0° |
| C08 | C07 | H071 | H072 | 122.3° | 123.8° |
| C07 | C08 | H082 | H081 | 121.6° | 122.0° |
| C07 | C08 | N09 | H091 | 162.6° | 163.0° |
| C07 | C06 | C05 | C04 | 62.7° | 70.3° |
| C06 | C07 | C08 | N09 | 28.1° | 25.2° |
| C07 | C06 | C05 | C10 | 118.1° | 114.8° |
| C07 | C06 | C05 | H061 | 119.7° | 122.6° |
| C07 | C06 | C10 | H061 | 117.9° | 118.8° |
| C07 | C06 | C10 | N09 | 17.5° | 16.5° |
| C07 | C06 | C10 | O11 | 162.8° | 163.8° |
| C07 | C06 | C05 | H052 | 177.1° | 169.7° |
| C07 | C06 | C05 | H051 | 57.6° | 49.8° |
| C06 | C07 | H071 | H072 | 122.3° | 123.9° |
| C06 | C07 | C08 | H082 | 147.5° | 144.4° |
| C06 | C07 | C08 | H081 | 91.4° | 93.6° |
| C12 | C04 | C05 | H041 | 123.2° | 120.0° |
| C04 | C12 | O13 | H121 | 121.3° | 120.0° |
| C04 | C12 | O13 | H1 | 121.3° | 120.0° |
| C12 | C04 | C05 | C06 | 167.6° | 176.3° |
| C12 | C04 | C05 | H052 | 72.1° | 63.8° |
| C12 | C04 | C05 | H051 | 47.4° | 56.2° |
| C04 | C12 | H121 | H1 | 115.9° | 120.0° |
| C12 | C04 | N03 | H031 | 72.0° | 97.0° |
| C04 | C12 | O13 | H2 | 180.0° | 180.0° |
| C05 | C04 | C12 | O13 | 59.6° | 55.0° |
| C04 | C05 | C06 | H052 | 120.2° | 120.0° |
| C04 | C05 | C06 | H051 | 120.2° | 120.1° |
| C04 | C05 | C06 | C10 | 179.3° | 174.9° |
| C04 | C05 | H052 | H051 | 119.3° | 120.1° |
| C04 | C05 | C06 | H061 | 57.0° | 52.4° |
| C05 | C04 | C12 | H121 | 61.6° | 175.0° |
| C05 | C04 | N03 | H031 | 53.0° | 23.0° |
| C05 | C04 | C12 | H1 | 179.1° | 65.0° |
| C08 | N09 | C10 | C06 | 0.2° | 0.0° |
| C08 | N09 | C10 | H091 | 180.0° | 179.5° |
| C08 | N09 | C10 | O11 | 179.5° | 179.7° |
| N09 | C08 | C07 | H071 | 147.3° | 92.7° |
| N09 | C08 | C07 | H072 | 91.1° | 143.5° |
| N09 | C08 | H082 | H081 | 121.6° | 121.8° |
| O13 | C12 | C04 | H041 | 63.6° | 175.0° |
| O13 | C12 | H121 | H1 | 115.9° | 120.0° |
| C05 | C06 | C10 | H061 | 121.9° | 122.5° |
| C05 | C06 | C10 | N09 | 137.7° | 135.2° |
| C05 | C06 | C10 | O11 | 42.6° | 45.1° |
| C06 | C05 | C04 | H041 | 44.4° | 56.3° |
| C06 | C05 | H052 | H051 | 119.3° | 119.9° |
| C05 | C06 | C07 | H071 | 89.9° | 25.5° |
| C05 | C06 | C07 | H072 | 31.6° | 98.3° |
| C06 | C10 | N09 | O11 | 179.7° | 179.7° |
| C10 | C06 | C05 | H052 | 59.0° | 54.9° |
| C10 | C06 | C05 | H051 | 60.5° | 65.0° |
| C10 | C06 | C07 | H071 | 146.8° | 93.2° |
| C10 | C06 | C07 | H072 | 91.6° | 143.0° |
| C06 | C10 | N09 | H091 | 179.8° | 179.6° |
| N09 | C10 | C06 | H061 | 100.3° | 102.3° |
| C10 | N09 | C08 | H082 | 136.8° | 135.7° |
| C10 | N09 | C08 | H081 | 102.1° | 102.3° |
| O11 | C10 | C06 | H061 | 79.4° | 77.4° |
| O11 | C10 | N09 | H091 | 0.5° | 0.7° |
| H151 | C15 | C14 | H141 | 106.9° | 174.4° |
| H151 | C15 | C16 | H161 | 55.1° | 89.5° |
| H152 | C15 | C14 | H141 | 132.6° | 65.6° |
| H152 | C15 | C16 | H161 | 175.6° | 150.5° |
| H172 | C17 | C16 | H161 | 142.6° | 0.1° |
| H172 | C17 | C18 | H181 | 141.2° | 0.0° |
| H172 | C17 | C18 | H182 | 0.6° | 145.0° |
| H171 | C17 | C16 | H161 | 2.0° | 144.9° |
| H171 | C17 | C18 | H181 | 0.6° | 145.0° |
| H171 | C17 | C18 | H182 | 141.2° | 0.0° |
| H241 | C24 | C25 | H251 | 0.7° | 0.0° |
| H261 | C26 | C25 | H251 | 0.7° | 0.1° |
| H261 | C26 | C27 | H271 | 0.4° | 0.0° |
| H281 | C28 | C27 | H271 | 0.0° | 0.1° |
| H041 | C04 | C05 | H052 | 164.7° | 176.3° |
| H041 | C04 | C05 | H051 | 75.8° | 63.7° |
| H041 | C04 | C12 | H121 | 175.1° | 65.0° |
| H041 | C04 | N03 | H031 | 168.9° | 143.1° |
| H041 | C04 | C12 | H1 | 57.7° | 55.0° |
| H052 | C05 | C06 | H061 | 63.2° | 67.6° |
| H051 | C05 | C06 | H061 | 177.2° | 172.4° |
| H061 | C06 | C07 | H071 | 29.1° | 148.1° |
| H061 | C06 | C07 | H072 | 150.7° | 24.3° |
| H071 | C07 | C08 | H082 | 93.2° | 26.5° |
| H071 | C07 | C08 | H081 | 27.9° | 148.5° |
| H072 | C07 | C08 | H082 | 28.3° | 97.2° |
| H072 | C07 | C08 | H081 | 149.4° | 24.8° |
| H082 | C08 | N09 | H091 | 43.2° | 43.9° |
| H081 | C08 | N09 | H091 | 77.9° | 78.1° |
| H121 | C12 | O13 | H2 | 58.7° | 60.0° |
| H141 | C14 | N19 | H191 | 123.3° | 143.8° |
| H161 | C16 | C18 | H181 | 0.3° | 0.0° |
| H161 | C16 | C18 | H182 | 142.1° | 145.0° |
| H1 | C12 | O13 | H2 | 58.7° | 60.0° |
