N2J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| C24 | C25 | sing | 1.38Å | 1.42Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | C20 | doub | 1.40Å | 1.43Å | Aromatic |
| C21 | C20 | sing | 1.40Å | 1.41Å | Aromatic |
| C20 | C19 | sing | 1.48Å | 1.51Å | |
| C01 | C02 | doub | 1.33Å | 1.35Å | |
| C19 | C09 | sing | 1.51Å | 1.61Å | |
| C19 | C12 | doub | 1.32Å | 1.43Å | |
| C15 | C16 | sing | 1.53Å | 1.57Å | |
| C15 | C14 | sing | 1.53Å | 1.57Å | |
| C16 | C17 | sing | 1.53Å | 1.56Å | |
| C02 | C09 | sing | 1.51Å | 1.60Å | |
| C02 | C03 | sing | 1.48Å | 1.56Å | |
| C13 | C14 | sing | 1.53Å | 1.58Å | |
| C13 | C12 | sing | 1.51Å | 1.53Å | |
| C33 | C09 | sing | 1.54Å | 1.54Å | |
| C33 | C32 | sing | 1.54Å | 1.52Å | |
| C09 | C10 | sing | 1.55Å | 1.57Å | |
| C12 | C11 | sing | 1.51Å | 1.51Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| C03 | C08 | doub | 1.40Å | 1.42Å | Aromatic |
| C03 | C04 | sing | 1.40Å | 1.42Å | Aromatic |
| C08 | C07 | sing | 1.38Å | 1.41Å | Aromatic |
| C04 | C05 | doub | 1.38Å | 1.41Å | Aromatic |
| C07 | C06 | doub | 1.38Å | 1.40Å | Aromatic |
| C05 | C06 | sing | 1.38Å | 1.40Å | Aromatic |
| C32 | C26 | sing | 1.55Å | 1.55Å | |
| C11 | C10 | sing | 1.54Å | 1.52Å | |
| C10 | C26 | sing | 1.55Å | 1.57Å | |
| C26 | N27 | sing | 1.46Å | 1.50Å | |
| N27 | S28 | sing | 1.66Å | 1.65Å | |
| S28 | N30 | sing | 1.66Å | 1.66Å | |
| S28 | O31 | doub | 1.42Å | 1.42Å | |
| S28 | O29 | doub | 1.42Å | 1.43Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.08Å | 1.08Å | |
| C01 | H012 | sing | 1.08Å | 1.08Å | |
| C04 | H041 | sing | 1.08Å | 1.08Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H183 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| N27 | H271 | sing | 0.97Å | 1.00Å | |
| N30 | H302 | sing | 0.97Å | 1.00Å | |
| N30 | H301 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C23 | C22 | 117.0° | 120.3° |
| C23 | C24 | C25 | 121.0° | 120.1° |
| C24 | C23 | H231 | 121.5° | 119.8° |
| C23 | C24 | H241 | 119.5° | 120.0° |
| C23 | C22 | C21 | 120.9° | 120.2° |
| C23 | C22 | H221 | 119.6° | 119.8° |
| C22 | C23 | H231 | 121.5° | 119.9° |
| C24 | C25 | C20 | 123.8° | 119.9° |
| C25 | C24 | H241 | 119.5° | 119.9° |
| C24 | C25 | H251 | 118.1° | 120.1° |
| C22 | C21 | C20 | 124.8° | 119.9° |
| C22 | C21 | H211 | 117.6° | 120.1° |
| C21 | C22 | H221 | 119.5° | 120.0° |
| C25 | C20 | C21 | 112.5° | 119.7° |
| C25 | C20 | C19 | 125.4° | 120.2° |
| C20 | C25 | H251 | 118.1° | 120.1° |
| C21 | C20 | C19 | 122.1° | 120.1° |
| C20 | C21 | H211 | 117.6° | 120.1° |
| C20 | C19 | C09 | 122.5° | 124.5° |
| C20 | C19 | C12 | 128.3° | 124.5° |
| C01 | C02 | C09 | 117.0° | 120.0° |
| C01 | C02 | C03 | 118.0° | 120.0° |
| C02 | C01 | H011 | 120.0° | 120.0° |
| C02 | C01 | H012 | 120.0° | 120.0° |
| C09 | C19 | C12 | 109.0° | 111.0° |
| C19 | C09 | C02 | 119.0° | 111.7° |
| C19 | C09 | C33 | 107.7° | 110.2° |
| C19 | C09 | C10 | 102.5° | 104.6° |
| C19 | C12 | C13 | 131.5° | 124.6° |
| C19 | C12 | C11 | 107.7° | 110.9° |
| C16 | C15 | C14 | 116.7° | 109.5° |
| C15 | C16 | C17 | 117.1° | 109.5° |
| C16 | C15 | H152 | 107.6° | 109.5° |
| C16 | C15 | H151 | 107.6° | 109.5° |
| C15 | C16 | H161 | 107.5° | 109.4° |
| C15 | C16 | H162 | 107.5° | 109.5° |
| C15 | C14 | C13 | 117.5° | 109.5° |
| C15 | C14 | H141 | 107.4° | 109.5° |
| C15 | C14 | H142 | 107.4° | 109.5° |
| C14 | C15 | H152 | 107.7° | 109.4° |
| C14 | C15 | H151 | 107.6° | 109.5° |
| C16 | C17 | C18 | 116.1° | 109.5° |
| C17 | C16 | H161 | 107.5° | 109.4° |
| C17 | C16 | H162 | 107.5° | 109.5° |
| C16 | C17 | H172 | 107.8° | 109.4° |
| C16 | C17 | H171 | 107.8° | 109.5° |
| C09 | C02 | C03 | 125.0° | 120.0° |
| C02 | C09 | C33 | 111.0° | 111.6° |
| C02 | C09 | C10 | 111.2° | 111.8° |
| C02 | C03 | C08 | 121.6° | 120.1° |
| C02 | C03 | C04 | 125.4° | 120.2° |
| C14 | C13 | C12 | 117.8° | 109.5° |
| C14 | C13 | H132 | 107.3° | 109.4° |
| C14 | C13 | H131 | 107.3° | 109.4° |
| C13 | C14 | H141 | 107.4° | 109.4° |
| C13 | C14 | H142 | 107.4° | 109.4° |
| C13 | C12 | C11 | 118.9° | 124.5° |
| C12 | C13 | H132 | 107.4° | 109.5° |
| C12 | C13 | H131 | 107.3° | 109.5° |
| C09 | C33 | C32 | 104.8° | 106.7° |
| C33 | C09 | C10 | 104.1° | 106.5° |
| C09 | C33 | H331 | 110.6° | 110.0° |
| C09 | C33 | H332 | 110.6° | 110.0° |
| C33 | C32 | C26 | 106.0° | 103.9° |
| C33 | C32 | H321 | 110.4° | 110.0° |
| C33 | C32 | H322 | 110.3° | 111.4° |
| C32 | C33 | H331 | 110.6° | 108.9° |
| C32 | C33 | H332 | 110.6° | 111.1° |
| C09 | C10 | C11 | 105.7° | 101.6° |
| C09 | C10 | C26 | 108.4° | 104.3° |
| C09 | C10 | H101 | 109.8° | 114.4° |
| C12 | C11 | C10 | 105.8° | 105.0° |
| C12 | C11 | H112 | 110.4° | 110.4° |
| C12 | C11 | H111 | 110.4° | 110.4° |
| C18 | C17 | H172 | 107.8° | 109.5° |
| C18 | C17 | H171 | 107.8° | 109.5° |
| C17 | C18 | H181 | 109.5° | 109.5° |
| C17 | C18 | H183 | 109.4° | 109.5° |
| C17 | C18 | H182 | 109.5° | 109.5° |
| C08 | C03 | C04 | 113.1° | 119.7° |
| C03 | C08 | C07 | 124.0° | 119.9° |
| C03 | C08 | H081 | 118.0° | 120.1° |
| C03 | C04 | C05 | 123.9° | 119.9° |
| C03 | C04 | H041 | 118.1° | 120.0° |
| C08 | C07 | C06 | 120.9° | 120.2° |
| C08 | C07 | H071 | 119.6° | 119.9° |
| C07 | C08 | H081 | 118.0° | 120.1° |
| C04 | C05 | C06 | 120.9° | 120.2° |
| C05 | C04 | H041 | 118.1° | 120.1° |
| C04 | C05 | H051 | 119.5° | 119.9° |
| C07 | C06 | C05 | 117.2° | 120.2° |
| C07 | C06 | H061 | 121.4° | 119.9° |
| C06 | C07 | H071 | 119.5° | 119.9° |
| C06 | C05 | H051 | 119.5° | 119.9° |
| C05 | C06 | H061 | 121.4° | 119.9° |
| C32 | C26 | C10 | 102.6° | 103.1° |
| C32 | C26 | N27 | 114.8° | 110.7° |
| C32 | C26 | H261 | 108.1° | 110.8° |
| C26 | C32 | H321 | 110.3° | 110.5° |
| C26 | C32 | H322 | 110.4° | 110.5° |
| C11 | C10 | C26 | 112.6° | 108.7° |
| C10 | C11 | H112 | 110.4° | 110.4° |
| C10 | C11 | H111 | 110.4° | 110.3° |
| C11 | C10 | H101 | 110.5° | 113.5° |
| C10 | C26 | N27 | 114.5° | 110.7° |
| C26 | C10 | H101 | 109.8° | 113.4° |
| C10 | C26 | H261 | 107.8° | 110.7° |
| C26 | N27 | S28 | 126.6° | 120.0° |
| N27 | C26 | H261 | 108.7° | 110.6° |
| C26 | N27 | H271 | 105.0° | 120.0° |
| N27 | S28 | N30 | 107.8° | 107.2° |
| N27 | S28 | O31 | 106.6° | 106.4° |
| N27 | S28 | O29 | 110.3° | 106.4° |
| S28 | N27 | H271 | 105.0° | 119.9° |
| N30 | S28 | O31 | 109.2° | 106.4° |
| N30 | S28 | O29 | 107.2° | 106.4° |
| S28 | N30 | H302 | 109.5° | 120.0° |
| S28 | N30 | H301 | 109.5° | 120.0° |
| O31 | S28 | O29 | 115.6° | 123.2° |
| H112 | C11 | H111 | 109.5° | 110.3° |
| H132 | C13 | H131 | 109.5° | 109.5° |
| H011 | C01 | H012 | 120.0° | 120.0° |
| H141 | C14 | H142 | 109.5° | 109.4° |
| H152 | C15 | H151 | 109.5° | 109.4° |
| H161 | C16 | H162 | 109.4° | 109.5° |
| H172 | C17 | H171 | 109.5° | 109.4° |
| H181 | C18 | H183 | 109.5° | 109.4° |
| H181 | C18 | H182 | 109.5° | 109.5° |
| H183 | C18 | H182 | 109.5° | 109.5° |
| H321 | C32 | H322 | 109.5° | 110.4° |
| H331 | C33 | H332 | 109.5° | 110.1° |
| H302 | N30 | H301 | 109.4° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C23 | C22 | H231 | 180.0° | 179.8° |
| C23 | C24 | C25 | H241 | 180.0° | 179.7° |
| C24 | C23 | C22 | C21 | 0.0° | 0.1° |
| C23 | C24 | C25 | C20 | 0.2° | 0.6° |
| C24 | C23 | C22 | H221 | 180.0° | 180.0° |
| C23 | C24 | C25 | H251 | 179.8° | 180.0° |
| C22 | C23 | C24 | C25 | 0.0° | 0.2° |
| C23 | C22 | C21 | H221 | 180.0° | 179.9° |
| C23 | C22 | C21 | C20 | 0.2° | 0.1° |
| C23 | C22 | C21 | H211 | 179.8° | 179.9° |
| C22 | C23 | C24 | H241 | 180.0° | 179.9° |
| C24 | C25 | C20 | H251 | 180.0° | 179.4° |
| C24 | C25 | C20 | C21 | 0.3° | 0.6° |
| C24 | C25 | C20 | C19 | 179.9° | 179.7° |
| C25 | C24 | C23 | H231 | 179.9° | 180.0° |
| C22 | C21 | C20 | C25 | 0.3° | 0.3° |
| C22 | C21 | C20 | H211 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 179.9° | 180.0° |
| C21 | C22 | C23 | H231 | 180.0° | 179.7° |
| C25 | C20 | C21 | C19 | 179.7° | 179.7° |
| C25 | C20 | C19 | C09 | 69.0° | 69.4° |
| C25 | C20 | C19 | C12 | 116.7° | 110.5° |
| C25 | C20 | C21 | H211 | 179.7° | 179.7° |
| C20 | C25 | C24 | H241 | 179.8° | 179.7° |
| C21 | C20 | C19 | C09 | 110.6° | 110.3° |
| C21 | C20 | C19 | C12 | 63.7° | 69.8° |
| C20 | C21 | C22 | H221 | 179.8° | 180.0° |
| C21 | C20 | C25 | H251 | 179.7° | 180.0° |
| C20 | C19 | C09 | C12 | 175.2° | 179.9° |
| C20 | C19 | C09 | C02 | 61.9° | 42.6° |
| C20 | C19 | C12 | C13 | 3.1° | 0.1° |
| C20 | C19 | C09 | C33 | 65.5° | 82.1° |
| C20 | C19 | C09 | C10 | 175.0° | 163.7° |
| C20 | C19 | C12 | C11 | 166.9° | 179.9° |
| C19 | C20 | C21 | H211 | 0.1° | 0.0° |
| C19 | C20 | C25 | H251 | 0.1° | 0.3° |
| C01 | C02 | C09 | C19 | 99.5° | 115.8° |
| C01 | C02 | C09 | C03 | 179.3° | 180.0° |
| C01 | C02 | C09 | C33 | 26.3° | 8.1° |
| C01 | C02 | C09 | C10 | 141.8° | 127.3° |
| C01 | C02 | C03 | C08 | 140.8° | 75.1° |
| C01 | C02 | C03 | C04 | 40.0° | 104.7° |
| C02 | C01 | H011 | H012 | 180.0° | 179.9° |
| C19 | C09 | C02 | C33 | 125.8° | 123.9° |
| C19 | C09 | C02 | C10 | 118.7° | 116.9° |
| C19 | C09 | C02 | C03 | 79.8° | 64.2° |
| C09 | C19 | C12 | C13 | 177.9° | 180.0° |
| C19 | C09 | C33 | C10 | 108.4° | 113.0° |
| C19 | C09 | C33 | C32 | 79.1° | 109.8° |
| C09 | C19 | C12 | C11 | 18.3° | 0.0° |
| C19 | C09 | C10 | C11 | 18.2° | 24.7° |
| C19 | C09 | C10 | C26 | 102.7° | 137.7° |
| C19 | C09 | C10 | H101 | 137.4° | 98.0° |
| C19 | C09 | C33 | H331 | 40.1° | 8.1° |
| C19 | C09 | C33 | H332 | 161.6° | 129.5° |
| C12 | C19 | C09 | C02 | 122.9° | 137.5° |
| C19 | C12 | C13 | C14 | 107.9° | 95.0° |
| C19 | C12 | C13 | C11 | 162.3° | 179.9° |
| C12 | C19 | C09 | C33 | 109.7° | 97.8° |
| C12 | C19 | C09 | C10 | 0.2° | 16.4° |
| C19 | C12 | C11 | C10 | 30.2° | 16.5° |
| C19 | C12 | C11 | H112 | 89.2° | 135.4° |
| C19 | C12 | C11 | H111 | 149.6° | 102.4° |
| C19 | C12 | C13 | H132 | 130.9° | 145.0° |
| C19 | C12 | C13 | H131 | 13.3° | 25.0° |
| C16 | C15 | C14 | H152 | 121.0° | 120.0° |
| C16 | C15 | C14 | H151 | 121.0° | 120.0° |
| C15 | C16 | C17 | H161 | 121.1° | 119.9° |
| C15 | C16 | C17 | H162 | 121.1° | 120.1° |
| C16 | C15 | C14 | C13 | 176.7° | 180.0° |
| C15 | C16 | C17 | C18 | 174.3° | 180.0° |
| C16 | C15 | C14 | H141 | 62.1° | 60.0° |
| C16 | C15 | C14 | H142 | 55.6° | 60.0° |
| C16 | C15 | H152 | H151 | 116.7° | 120.0° |
| C15 | C16 | H161 | H162 | 116.5° | 120.0° |
| C15 | C16 | C17 | H172 | 53.3° | 60.0° |
| C15 | C16 | C17 | H171 | 64.8° | 59.9° |
| C14 | C15 | C16 | C17 | 127.8° | 180.0° |
| C15 | C14 | C13 | H141 | 121.1° | 120.0° |
| C15 | C14 | C13 | H142 | 121.2° | 120.0° |
| C15 | C14 | C13 | C12 | 41.4° | 180.0° |
| C15 | C14 | C13 | H132 | 162.7° | 60.0° |
| C15 | C14 | C13 | H131 | 79.8° | 60.0° |
| C15 | C14 | H141 | H142 | 116.4° | 120.0° |
| C14 | C15 | H152 | H151 | 116.7° | 120.0° |
| C14 | C15 | C16 | H161 | 111.1° | 60.0° |
| C14 | C15 | C16 | H162 | 6.7° | 60.0° |
| C16 | C17 | C18 | H172 | 121.0° | 120.0° |
| C16 | C17 | C18 | H171 | 121.0° | 120.0° |
| C17 | C16 | C15 | H152 | 111.2° | 60.0° |
| C17 | C16 | C15 | H151 | 6.7° | 60.0° |
| C17 | C16 | H161 | H162 | 116.5° | 120.0° |
| C16 | C17 | H172 | H171 | 117.0° | 119.9° |
| C16 | C17 | C18 | H181 | 180.0° | 60.0° |
| C16 | C17 | C18 | H183 | 60.0° | 60.0° |
| C16 | C17 | C18 | H182 | 60.0° | 180.0° |
| C02 | C09 | C33 | C10 | 119.7° | 122.3° |
| C02 | C09 | C33 | C32 | 149.0° | 125.4° |
| C09 | C02 | C03 | C08 | 38.6° | 104.9° |
| C09 | C02 | C03 | C04 | 140.7° | 75.3° |
| C02 | C09 | C10 | C11 | 110.0° | 145.8° |
| C02 | C09 | C10 | C26 | 129.1° | 101.3° |
| C02 | C09 | C10 | H101 | 9.2° | 23.1° |
| C09 | C02 | C01 | H011 | 179.4° | 173.4° |
| C09 | C02 | C01 | H012 | 0.6° | 6.6° |
| C02 | C09 | C33 | H331 | 91.7° | 116.6° |
| C02 | C09 | C33 | H332 | 29.7° | 4.8° |
| C03 | C02 | C09 | C33 | 154.3° | 171.9° |
| C03 | C02 | C09 | C10 | 38.9° | 52.7° |
| C02 | C03 | C08 | C04 | 179.3° | 179.8° |
| C02 | C03 | C08 | C07 | 179.7° | 179.7° |
| C02 | C03 | C04 | C05 | 179.8° | 180.0° |
| C03 | C02 | C01 | H011 | 0.0° | 6.6° |
| C03 | C02 | C01 | H012 | 180.0° | 173.4° |
| C02 | C03 | C04 | H041 | 0.2° | 0.0° |
| C02 | C03 | C08 | H081 | 0.3° | 0.1° |
| C14 | C13 | C12 | H132 | 121.2° | 120.0° |
| C14 | C13 | C12 | H131 | 121.2° | 120.0° |
| C14 | C13 | C12 | C11 | 54.4° | 85.0° |
| C14 | C13 | H132 | H131 | 116.2° | 119.9° |
| C13 | C14 | H141 | H142 | 116.3° | 119.9° |
| C13 | C14 | C15 | H152 | 55.7° | 60.0° |
| C13 | C14 | C15 | H151 | 62.3° | 60.0° |
| C13 | C12 | C11 | C10 | 163.6° | 163.4° |
| C13 | C12 | C11 | H112 | 77.0° | 44.5° |
| C13 | C12 | C11 | H111 | 44.2° | 77.6° |
| C12 | C13 | H132 | H131 | 116.2° | 120.0° |
| C12 | C13 | C14 | H141 | 79.7° | 59.9° |
| C12 | C13 | C14 | H142 | 162.6° | 60.0° |
| C09 | C33 | C32 | H331 | 119.3° | 118.7° |
| C09 | C33 | C32 | H332 | 119.3° | 119.9° |
| C09 | C33 | C32 | C26 | 39.1° | 25.9° |
| C33 | C09 | C10 | C11 | 130.4° | 92.0° |
| C33 | C09 | C10 | C26 | 9.5° | 20.9° |
| C33 | C09 | C10 | H101 | 110.4° | 145.3° |
| C09 | C33 | C32 | H321 | 80.4° | 144.1° |
| C09 | C33 | C32 | H322 | 158.5° | 93.1° |
| C09 | C33 | H331 | H332 | 122.2° | 121.4° |
| C32 | C33 | C09 | C10 | 29.3° | 3.1° |
| C33 | C32 | C26 | H321 | 119.5° | 117.9° |
| C33 | C32 | C26 | H322 | 119.5° | 119.6° |
| C33 | C32 | C26 | C10 | 31.9° | 38.7° |
| C33 | C32 | C26 | N27 | 156.7° | 157.1° |
| C33 | C32 | C26 | H261 | 81.9° | 79.8° |
| C33 | C32 | H321 | H322 | 121.6° | 123.4° |
| C32 | C33 | H331 | H332 | 122.1° | 122.0° |
| C09 | C10 | C11 | C12 | 29.7° | 24.8° |
| C09 | C10 | C26 | C32 | 13.3° | 36.7° |
| C09 | C10 | C11 | C26 | 118.1° | 109.6° |
| C09 | C10 | C11 | H101 | 118.8° | 123.3° |
| C09 | C10 | C26 | H101 | 120.0° | 125.1° |
| C09 | C10 | C26 | N27 | 138.4° | 155.1° |
| C09 | C10 | C11 | H112 | 89.7° | 143.7° |
| C09 | C10 | C11 | H111 | 149.1° | 94.2° |
| C09 | C10 | C26 | H261 | 100.6° | 81.8° |
| C10 | C09 | C33 | H331 | 148.5° | 121.1° |
| C10 | C09 | C33 | H332 | 90.0° | 117.5° |
| C12 | C11 | C10 | H112 | 119.4° | 118.9° |
| C12 | C11 | C10 | H111 | 119.4° | 119.0° |
| C12 | C11 | C10 | C26 | 88.4° | 134.4° |
| C12 | C11 | H112 | H111 | 121.7° | 122.3° |
| C11 | C12 | C13 | H132 | 66.8° | 35.0° |
| C11 | C12 | C13 | H131 | 175.6° | 155.0° |
| C12 | C11 | C10 | H101 | 148.5° | 98.5° |
| C18 | C17 | C16 | H161 | 64.6° | 60.0° |
| C18 | C17 | C16 | H162 | 53.2° | 60.0° |
| C18 | C17 | H172 | H171 | 117.0° | 120.1° |
| C17 | C18 | H181 | H183 | 120.0° | 120.0° |
| C17 | C18 | H181 | H182 | 120.0° | 120.0° |
| C17 | C18 | H183 | H182 | 120.0° | 120.0° |
| C03 | C08 | C07 | H081 | 180.0° | 179.8° |
| C08 | C03 | C04 | C05 | 0.5° | 0.2° |
| C03 | C08 | C07 | C06 | 0.1° | 0.6° |
| C08 | C03 | C04 | H041 | 179.5° | 179.7° |
| C03 | C08 | C07 | H071 | 179.9° | 179.7° |
| C04 | C03 | C08 | C07 | 0.4° | 0.5° |
| C03 | C04 | C05 | H041 | 180.0° | 180.0° |
| C03 | C04 | C05 | C06 | 0.4° | 0.0° |
| C03 | C04 | C05 | H051 | 179.6° | 180.0° |
| C04 | C03 | C08 | H081 | 179.6° | 179.7° |
| C08 | C07 | C06 | H071 | 180.0° | 179.7° |
| C08 | C07 | C06 | C05 | 0.0° | 0.3° |
| C08 | C07 | C06 | H061 | 180.0° | 179.7° |
| C04 | C05 | C06 | C07 | 0.1° | 0.0° |
| C04 | C05 | C06 | H051 | 180.0° | 180.0° |
| C04 | C05 | C06 | H061 | 179.8° | 180.0° |
| C07 | C06 | C05 | H061 | 180.0° | 179.9° |
| C07 | C06 | C05 | H051 | 179.9° | 180.0° |
| C06 | C07 | C08 | H081 | 179.9° | 179.6° |
| C06 | C05 | C04 | H041 | 179.6° | 180.0° |
| C05 | C06 | C07 | H071 | 180.0° | 179.9° |
| C32 | C26 | C10 | C11 | 103.2° | 71.0° |
| C32 | C26 | C10 | N27 | 125.0° | 118.4° |
| C32 | C26 | C10 | H261 | 113.9° | 118.5° |
| C32 | C26 | N27 | H261 | 121.1° | 123.2° |
| C32 | C26 | N27 | S28 | 150.3° | 101.3° |
| C32 | C26 | C10 | H101 | 133.3° | 161.8° |
| C26 | C32 | H321 | H322 | 121.6° | 122.5° |
| C26 | C32 | C33 | H331 | 158.4° | 144.6° |
| C26 | C32 | C33 | H332 | 80.2° | 94.0° |
| C32 | C26 | N27 | H271 | 87.4° | 78.7° |
| C11 | C10 | C26 | H101 | 123.5° | 127.2° |
| C11 | C10 | C26 | N27 | 21.8° | 47.4° |
| C10 | C11 | H112 | H111 | 121.7° | 122.2° |
| C11 | C10 | C26 | H261 | 142.9° | 170.5° |
| C10 | C26 | N27 | H261 | 120.6° | 123.1° |
| C10 | C26 | N27 | S28 | 91.4° | 145.0° |
| C26 | C10 | C11 | H112 | 152.2° | 106.8° |
| C26 | C10 | C11 | H111 | 31.0° | 15.4° |
| C10 | C26 | C32 | H321 | 87.6° | 156.6° |
| C10 | C26 | C32 | H322 | 151.3° | 80.9° |
| C10 | C26 | N27 | H271 | 30.9° | 35.0° |
| C26 | N27 | S28 | H271 | 122.3° | 180.0° |
| C26 | N27 | S28 | N30 | 95.6° | 65.0° |
| C26 | N27 | S28 | O31 | 21.5° | 48.5° |
| C26 | N27 | S28 | O29 | 147.7° | 178.5° |
| N27 | C26 | C10 | H101 | 101.7° | 79.8° |
| N27 | C26 | C32 | H321 | 37.2° | 85.0° |
| N27 | C26 | C32 | H322 | 83.9° | 37.5° |
| N27 | S28 | N30 | O31 | 115.4° | 113.5° |
| N27 | S28 | N30 | O29 | 118.7° | 113.5° |
| N27 | S28 | O31 | O29 | 122.9° | 123.0° |
| S28 | N27 | C26 | H261 | 29.2° | 21.9° |
| N27 | S28 | N30 | H302 | 180.0° | 0.0° |
| N27 | S28 | N30 | H301 | 60.0° | 180.0° |
| N30 | S28 | O31 | O29 | 120.9° | 123.0° |
| N30 | S28 | N27 | H271 | 26.7° | 115.1° |
| S28 | N30 | H302 | H301 | 120.0° | 180.0° |
| O31 | S28 | N27 | H271 | 143.8° | 131.5° |
| O31 | S28 | N30 | H302 | 64.6° | 113.5° |
| O31 | S28 | N30 | H301 | 55.4° | 66.5° |
| O29 | S28 | N27 | H271 | 90.0° | 1.5° |
| O29 | S28 | N30 | H302 | 61.3° | 113.5° |
| O29 | S28 | N30 | H301 | 178.7° | 66.5° |
| H112 | C11 | C10 | H101 | 29.1° | 20.3° |
| H111 | C11 | C10 | H101 | 92.1° | 142.5° |
| H132 | C13 | C14 | H141 | 41.5° | 180.0° |
| H132 | C13 | C14 | H142 | 76.2° | 60.1° |
| H131 | C13 | C14 | H141 | 159.1° | 60.1° |
| H131 | C13 | C14 | H142 | 41.4° | 180.0° |
| H101 | C10 | C26 | H261 | 19.4° | 43.3° |
| H041 | C04 | C05 | H051 | 0.4° | 0.0° |
| H051 | C05 | C06 | H061 | 0.2° | 0.0° |
| H061 | C06 | C07 | H071 | 0.0° | 0.0° |
| H071 | C07 | C08 | H081 | 0.1° | 0.1° |
| H141 | C14 | C15 | H152 | 176.8° | 180.0° |
| H141 | C14 | C15 | H151 | 58.9° | 60.0° |
| H142 | C14 | C15 | H152 | 65.5° | 60.0° |
| H142 | C14 | C15 | H151 | 176.6° | 180.0° |
| H152 | C15 | C16 | H161 | 9.9° | 180.0° |
| H152 | C15 | C16 | H162 | 127.7° | 60.0° |
| H151 | C15 | C16 | H161 | 127.9° | 60.0° |
| H151 | C15 | C16 | H162 | 114.4° | 180.0° |
| H161 | C16 | C17 | H172 | 174.4° | 179.9° |
| H161 | C16 | C17 | H171 | 56.4° | 60.0° |
| H162 | C16 | C17 | H172 | 67.8° | 60.1° |
| H162 | C16 | C17 | H171 | 174.1° | 180.0° |
| H172 | C17 | C18 | H181 | 59.0° | 180.0° |
| H172 | C17 | C18 | H183 | 179.0° | 60.0° |
| H172 | C17 | C18 | H182 | 61.0° | 60.0° |
| H171 | C17 | C18 | H181 | 59.0° | 60.0° |
| H171 | C17 | C18 | H183 | 61.0° | 180.0° |
| H171 | C17 | C18 | H182 | 179.0° | 60.0° |
| H181 | C18 | H183 | H182 | 120.0° | 120.0° |
| H211 | C21 | C22 | H221 | 0.1° | 0.0° |
| H221 | C22 | C23 | H231 | 0.0° | 0.2° |
| H231 | C23 | C24 | H241 | 0.0° | 0.2° |
| H241 | C24 | C25 | H251 | 0.2° | 0.3° |
| H261 | C26 | C32 | H321 | 158.7° | 38.1° |
| H261 | C26 | C32 | H322 | 37.6° | 160.6° |
| H261 | C26 | N27 | H271 | 151.5° | 158.1° |
| H321 | C32 | C33 | H331 | 38.9° | 97.1° |
| H321 | C32 | C33 | H332 | 160.4° | 24.2° |
| H322 | C32 | C33 | H331 | 82.2° | 25.6° |
| H322 | C32 | C33 | H332 | 39.3° | 147.0° |
