A1IMO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O35 | C34 | sing | 1.43Å | 1.40Å | |
| C34 | C33 | sing | 1.53Å | 1.53Å | |
| C33 | C32 | sing | 1.53Å | 1.54Å | |
| C32 | N31 | sing | 1.46Å | 1.49Å | |
| O01 | C02 | doub | 1.22Å | 1.24Å | |
| C26 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| N31 | C02 | sing | 1.35Å | 1.41Å | |
| N31 | C30 | sing | 1.34Å | 1.47Å | |
| CL25 | C24 | sing | 1.74Å | 1.77Å | |
| C27 | C21 | sing | 1.38Å | 1.39Å | Aromatic |
| C02 | C03 | sing | 1.41Å | 1.46Å | |
| O36 | C30 | doub | 1.22Å | 1.23Å | |
| C24 | C23 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | N28 | sing | 1.35Å | 1.50Å | |
| C21 | C20 | sing | 1.51Å | 1.51Å | |
| C21 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C03 | N19 | sing | 1.39Å | 1.45Å | Aromatic |
| C03 | C04 | doub | 1.39Å | 1.41Å | Aromatic |
| C20 | N19 | sing | 1.46Å | 1.46Å | |
| C23 | C22 | sing | 1.38Å | 1.40Å | Aromatic |
| N28 | C04 | sing | 1.39Å | 1.38Å | |
| N28 | C29 | sing | 1.47Å | 1.47Å | |
| N19 | C06 | sing | 1.35Å | 1.40Å | Aromatic |
| C04 | N05 | sing | 1.33Å | 1.42Å | Aromatic |
| C06 | N05 | doub | 1.32Å | 1.36Å | Aromatic |
| C06 | O07 | sing | 1.35Å | 1.38Å | |
| O07 | C08 | sing | 1.43Å | 1.43Å | |
| C08 | C09 | sing | 1.53Å | 1.54Å | |
| C08 | C18 | sing | 1.53Å | 1.53Å | |
| C09 | C10 | sing | 1.53Å | 1.55Å | |
| C18 | C15 | sing | 1.53Å | 1.54Å | |
| C10 | C11 | sing | 1.55Å | 1.53Å | |
| C10 | C12 | sing | 1.53Å | 1.54Å | |
| C10 | N13 | sing | 1.45Å | 1.53Å | |
| C15 | N13 | sing | 1.45Å | 1.53Å | |
| C15 | C17 | sing | 1.53Å | 1.54Å | |
| C15 | C16 | sing | 1.55Å | 1.54Å | |
| N13 | O14 | sing | 1.46Å | 1.24Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.09Å | 1.10Å | |
| C09 | H092 | sing | 1.09Å | 1.10Å | |
| C11 | H113 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H123 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C16 | H163 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C17 | H172 | sing | 1.09Å | 1.10Å | |
| C17 | H173 | sing | 1.09Å | 1.10Å | |
| C17 | H171 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C26 | H261 | sing | 1.08Å | 1.08Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H293 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| O14 | H1 | sing | 0.97Å | 0.95Å | |
| O35 | H351 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O35 | C34 | C33 | 107.2° | 109.5° |
| O35 | C34 | H341 | 110.0° | 109.5° |
| O35 | C34 | H342 | 110.0° | 109.4° |
| C34 | O35 | H351 | 109.5° | 114.0° |
| C34 | C33 | C32 | 112.1° | 109.5° |
| C34 | C33 | H331 | 108.8° | 109.5° |
| C34 | C33 | H332 | 108.8° | 109.5° |
| C33 | C34 | H341 | 110.0° | 109.5° |
| C33 | C34 | H342 | 110.0° | 109.5° |
| C33 | C32 | N31 | 115.2° | 109.5° |
| C33 | C32 | H322 | 108.0° | 109.5° |
| C33 | C32 | H321 | 108.0° | 109.5° |
| C32 | C33 | H331 | 108.8° | 109.5° |
| C32 | C33 | H332 | 108.8° | 109.5° |
| C32 | N31 | C02 | 120.6° | 119.5° |
| C32 | N31 | C30 | 119.2° | 119.5° |
| N31 | C32 | H322 | 108.0° | 109.5° |
| N31 | C32 | H321 | 108.0° | 109.5° |
| O01 | C02 | N31 | 120.8° | 120.4° |
| O01 | C02 | C03 | 122.0° | 120.3° |
| C27 | C26 | C24 | 118.7° | 120.0° |
| C26 | C27 | C21 | 120.8° | 120.0° |
| C27 | C26 | H261 | 120.7° | 120.0° |
| C26 | C27 | H271 | 119.6° | 120.0° |
| C26 | C24 | CL25 | 117.9° | 120.0° |
| C26 | C24 | C23 | 122.4° | 120.0° |
| C24 | C26 | H261 | 120.6° | 120.0° |
| C02 | N31 | C30 | 120.1° | 121.0° |
| N31 | C02 | C03 | 117.3° | 119.3° |
| N31 | C30 | O36 | 119.9° | 119.2° |
| N31 | C30 | N28 | 120.4° | 121.6° |
| CL25 | C24 | C23 | 119.7° | 120.0° |
| C27 | C21 | C20 | 119.8° | 120.0° |
| C27 | C21 | C22 | 118.9° | 120.0° |
| C21 | C27 | H271 | 119.6° | 120.0° |
| C02 | C03 | N19 | 131.0° | 134.5° |
| C02 | C03 | C04 | 122.7° | 119.2° |
| O36 | C30 | N28 | 119.7° | 119.2° |
| C24 | C23 | C22 | 118.1° | 120.0° |
| C24 | C23 | H231 | 121.0° | 120.0° |
| C30 | N28 | C04 | 117.0° | 120.1° |
| C30 | N28 | C29 | 121.2° | 119.9° |
| C20 | C21 | C22 | 121.4° | 120.0° |
| C21 | C20 | N19 | 115.2° | 109.5° |
| C21 | C20 | H201 | 108.0° | 109.5° |
| C21 | C20 | H202 | 108.0° | 109.5° |
| C21 | C22 | C23 | 121.2° | 120.0° |
| C21 | C22 | H221 | 119.4° | 120.0° |
| N19 | C03 | C04 | 106.3° | 106.3° |
| C03 | N19 | C20 | 126.7° | 126.6° |
| C03 | N19 | C06 | 105.2° | 106.9° |
| C03 | C04 | N28 | 122.4° | 118.8° |
| C03 | C04 | N05 | 109.9° | 107.4° |
| C20 | N19 | C06 | 128.1° | 126.6° |
| N19 | C20 | H201 | 108.1° | 109.5° |
| N19 | C20 | H202 | 108.0° | 109.5° |
| C23 | C22 | H221 | 119.4° | 120.0° |
| C22 | C23 | H231 | 121.0° | 120.0° |
| C04 | N28 | C29 | 121.7° | 120.0° |
| N28 | C04 | N05 | 127.6° | 133.8° |
| N28 | C29 | H291 | 109.5° | 109.5° |
| N28 | C29 | H292 | 109.5° | 109.5° |
| N28 | C29 | H293 | 109.5° | 109.5° |
| N19 | C06 | N05 | 113.4° | 109.6° |
| N19 | C06 | O07 | 122.7° | 125.2° |
| C04 | N05 | C06 | 105.1° | 109.9° |
| N05 | C06 | O07 | 123.9° | 125.2° |
| C06 | O07 | C08 | 120.4° | 117.0° |
| O07 | C08 | C09 | 109.7° | 109.2° |
| O07 | C08 | C18 | 107.7° | 109.2° |
| O07 | C08 | H081 | 111.8° | 108.9° |
| C09 | C08 | C18 | 107.0° | 108.5° |
| C08 | C09 | C10 | 112.3° | 110.4° |
| C09 | C08 | H081 | 110.2° | 110.5° |
| C08 | C09 | H091 | 108.7° | 109.3° |
| C08 | C09 | H092 | 108.8° | 109.4° |
| C08 | C18 | C15 | 112.4° | 110.4° |
| C18 | C08 | H081 | 110.3° | 110.4° |
| C08 | C18 | H182 | 108.7° | 109.4° |
| C08 | C18 | H181 | 108.7° | 109.4° |
| C09 | C10 | C11 | 109.7° | 107.5° |
| C09 | C10 | C12 | 111.5° | 109.6° |
| C09 | C10 | N13 | 110.7° | 113.0° |
| C10 | C09 | H091 | 108.8° | 109.4° |
| C10 | C09 | H092 | 108.8° | 109.5° |
| C18 | C15 | N13 | 111.3° | 112.9° |
| C18 | C15 | C17 | 110.4° | 109.5° |
| C18 | C15 | C16 | 110.3° | 107.6° |
| C15 | C18 | H182 | 108.7° | 109.5° |
| C15 | C18 | H181 | 108.7° | 109.4° |
| C11 | C10 | C12 | 107.9° | 107.2° |
| C11 | C10 | N13 | 107.5° | 108.2° |
| C10 | C11 | H113 | 109.5° | 109.5° |
| C10 | C11 | H112 | 109.4° | 109.5° |
| C10 | C11 | H111 | 109.5° | 109.5° |
| C12 | C10 | N13 | 109.3° | 111.2° |
| C10 | C12 | H121 | 109.5° | 109.5° |
| C10 | C12 | H123 | 109.5° | 109.5° |
| C10 | C12 | H122 | 109.5° | 109.4° |
| C10 | N13 | C15 | 119.8° | 120.3° |
| C10 | N13 | O14 | 117.7° | 112.2° |
| N13 | C15 | C17 | 110.0° | 111.2° |
| N13 | C15 | C16 | 106.8° | 108.2° |
| C15 | N13 | O14 | 116.7° | 112.1° |
| C17 | C15 | C16 | 107.9° | 107.2° |
| C15 | C17 | H172 | 109.5° | 109.5° |
| C15 | C17 | H173 | 109.5° | 109.5° |
| C15 | C17 | H171 | 109.5° | 109.5° |
| C15 | C16 | H163 | 109.5° | 109.4° |
| C15 | C16 | H162 | 109.5° | 109.4° |
| C15 | C16 | H161 | 109.4° | 109.5° |
| N13 | O14 | H1 | 109.5° | 114.0° |
| H091 | C09 | H092 | 109.5° | 108.8° |
| H113 | C11 | H112 | 109.5° | 109.5° |
| H113 | C11 | H111 | 109.4° | 109.4° |
| H112 | C11 | H111 | 109.5° | 109.5° |
| H121 | C12 | H123 | 109.5° | 109.5° |
| H121 | C12 | H122 | 109.5° | 109.4° |
| H123 | C12 | H122 | 109.5° | 109.5° |
| H163 | C16 | H162 | 109.5° | 109.5° |
| H163 | C16 | H161 | 109.5° | 109.5° |
| H162 | C16 | H161 | 109.5° | 109.5° |
| H172 | C17 | H173 | 109.4° | 109.5° |
| H172 | C17 | H171 | 109.5° | 109.5° |
| H173 | C17 | H171 | 109.5° | 109.4° |
| H182 | C18 | H181 | 109.5° | 108.8° |
| H201 | C20 | H202 | 109.5° | 109.5° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H291 | C29 | H293 | 109.5° | 109.5° |
| H292 | C29 | H293 | 109.5° | 109.4° |
| H322 | C32 | H321 | 109.5° | 109.4° |
| H331 | C33 | H332 | 109.5° | 109.5° |
| H341 | C34 | H342 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O35 | C34 | C33 | H341 | 119.6° | 120.0° |
| O35 | C34 | C33 | H342 | 119.6° | 119.9° |
| O35 | C34 | C33 | C32 | 52.1° | 180.0° |
| O35 | C34 | C33 | H331 | 68.3° | 60.0° |
| O35 | C34 | C33 | H332 | 172.5° | 60.0° |
| O35 | C34 | H341 | H342 | 121.1° | 120.0° |
| C34 | C33 | C32 | H331 | 120.4° | 120.0° |
| C34 | C33 | C32 | H332 | 120.4° | 120.0° |
| C34 | C33 | C32 | N31 | 175.8° | 180.0° |
| C34 | C33 | C32 | H322 | 54.9° | 60.0° |
| C34 | C33 | C32 | H321 | 63.4° | 60.0° |
| C34 | C33 | H331 | H332 | 118.8° | 120.0° |
| C33 | C34 | H341 | H342 | 121.0° | 120.0° |
| C33 | C34 | O35 | H351 | 180.0° | 180.0° |
| C33 | C32 | N31 | H322 | 120.8° | 120.0° |
| C33 | C32 | N31 | H321 | 120.9° | 120.1° |
| C33 | C32 | N31 | C02 | 86.0° | 90.0° |
| C33 | C32 | N31 | C30 | 94.2° | 90.1° |
| C33 | C32 | H322 | H321 | 117.4° | 120.0° |
| C32 | C33 | H331 | H332 | 118.8° | 120.0° |
| C32 | C33 | C34 | H341 | 171.7° | 60.0° |
| C32 | C33 | C34 | H342 | 67.5° | 60.0° |
| C32 | N31 | C02 | O01 | 0.2° | 0.3° |
| C32 | N31 | C02 | C30 | 179.8° | 179.9° |
| C32 | N31 | C02 | C03 | 180.0° | 180.0° |
| C32 | N31 | C30 | O36 | 0.0° | 0.0° |
| C32 | N31 | C30 | N28 | 180.0° | 180.0° |
| N31 | C32 | H322 | H321 | 117.4° | 119.9° |
| N31 | C32 | C33 | H331 | 63.8° | 60.0° |
| N31 | C32 | C33 | H332 | 55.4° | 60.0° |
| O01 | C02 | N31 | C03 | 179.9° | 179.8° |
| O01 | C02 | N31 | C30 | 180.0° | 179.7° |
| O01 | C02 | C03 | N19 | 0.4° | 0.2° |
| O01 | C02 | C03 | C04 | 179.9° | 179.7° |
| C27 | C26 | C24 | H261 | 180.0° | 179.5° |
| C27 | C26 | C24 | CL25 | 180.0° | 179.8° |
| C26 | C27 | C21 | H271 | 180.0° | 179.5° |
| C27 | C26 | C24 | C23 | 0.0° | 0.2° |
| C26 | C27 | C21 | C20 | 179.7° | 179.8° |
| C26 | C27 | C21 | C22 | 0.3° | 0.5° |
| C26 | C24 | CL25 | C23 | 180.0° | 180.0° |
| C24 | C26 | C27 | C21 | 0.2° | 0.5° |
| C26 | C24 | C23 | C22 | 0.0° | 0.0° |
| C26 | C24 | C23 | H231 | 180.0° | 180.0° |
| C24 | C26 | C27 | H271 | 179.8° | 180.0° |
| C02 | N31 | C30 | O36 | 179.9° | 179.9° |
| C02 | N31 | C30 | N28 | 0.1° | 0.1° |
| N31 | C02 | C03 | N19 | 179.8° | 180.0° |
| N31 | C02 | C03 | C04 | 0.1° | 0.0° |
| C02 | N31 | C32 | H322 | 153.2° | 30.0° |
| C02 | N31 | C32 | H321 | 34.9° | 149.9° |
| C30 | N31 | C02 | C03 | 0.1° | 0.1° |
| N31 | C30 | O36 | N28 | 180.0° | 179.9° |
| N31 | C30 | N28 | C04 | 0.1° | 0.1° |
| N31 | C30 | N28 | C29 | 179.9° | 180.0° |
| C30 | N31 | C32 | H322 | 26.6° | 149.9° |
| C30 | N31 | C32 | H321 | 145.0° | 30.0° |
| CL25 | C24 | C23 | C22 | 180.0° | 180.0° |
| CL25 | C24 | C23 | H231 | 0.0° | 0.0° |
| CL25 | C24 | C26 | H261 | 0.0° | 0.3° |
| C27 | C21 | C20 | C22 | 179.3° | 179.7° |
| C27 | C21 | C20 | N19 | 91.5° | 90.2° |
| C27 | C21 | C22 | C23 | 0.3° | 0.3° |
| C27 | C21 | C20 | H201 | 29.3° | 29.8° |
| C27 | C21 | C20 | H202 | 147.7° | 149.7° |
| C27 | C21 | C22 | H221 | 179.7° | 179.8° |
| C21 | C27 | C26 | H261 | 179.8° | 180.0° |
| C02 | C03 | N19 | C04 | 179.7° | 180.0° |
| C02 | C03 | N19 | C20 | 1.0° | 0.0° |
| C02 | C03 | C04 | N28 | 0.0° | 0.0° |
| C02 | C03 | N19 | C06 | 180.0° | 180.0° |
| C02 | C03 | C04 | N05 | 180.0° | 180.0° |
| O36 | C30 | N28 | C04 | 179.9° | 180.0° |
| O36 | C30 | N28 | C29 | 0.1° | 0.1° |
| C24 | C23 | C22 | C21 | 0.2° | 0.0° |
| C24 | C23 | C22 | H231 | 180.0° | 180.0° |
| C24 | C23 | C22 | H221 | 179.8° | 179.9° |
| C23 | C24 | C26 | H261 | 180.0° | 179.7° |
| C30 | N28 | C04 | C03 | 0.0° | 0.0° |
| C30 | N28 | C04 | C29 | 179.9° | 179.9° |
| C30 | N28 | C04 | N05 | 179.9° | 179.9° |
| C30 | N28 | C29 | H291 | 180.0° | 0.0° |
| C30 | N28 | C29 | H292 | 60.0° | 120.0° |
| C30 | N28 | C29 | H293 | 60.0° | 120.1° |
| C21 | C20 | N19 | C03 | 90.0° | 90.0° |
| C21 | C20 | N19 | H201 | 120.8° | 120.0° |
| C21 | C20 | N19 | H202 | 120.8° | 120.0° |
| C20 | C21 | C22 | C23 | 179.7° | 180.0° |
| C21 | C20 | N19 | C06 | 88.8° | 90.0° |
| C21 | C20 | H201 | H202 | 117.4° | 120.0° |
| C20 | C21 | C22 | H221 | 0.3° | 0.1° |
| C20 | C21 | C27 | H271 | 0.3° | 0.2° |
| C22 | C21 | C20 | N19 | 87.8° | 90.0° |
| C21 | C22 | C23 | H221 | 180.0° | 179.9° |
| C22 | C21 | C20 | H201 | 151.3° | 150.0° |
| C22 | C21 | C20 | H202 | 33.0° | 30.0° |
| C21 | C22 | C23 | H231 | 179.9° | 179.9° |
| C22 | C21 | C27 | H271 | 179.7° | 180.0° |
| C03 | N19 | C20 | C06 | 178.8° | 180.0° |
| N19 | C03 | C04 | N28 | 179.8° | 179.9° |
| N19 | C03 | C04 | N05 | 0.2° | 0.0° |
| C03 | N19 | C06 | N05 | 0.3° | 0.0° |
| C03 | N19 | C06 | O07 | 179.9° | 180.0° |
| C03 | N19 | C20 | H201 | 30.8° | 30.0° |
| C03 | N19 | C20 | H202 | 149.2° | 150.0° |
| C04 | C03 | N19 | C20 | 179.3° | 180.0° |
| C03 | C04 | N28 | N05 | 179.9° | 179.9° |
| C03 | C04 | N28 | C29 | 179.9° | 179.9° |
| C04 | C03 | N19 | C06 | 0.3° | 0.0° |
| C03 | C04 | N05 | C06 | 0.0° | 0.0° |
| C20 | N19 | C06 | N05 | 179.3° | 180.0° |
| C20 | N19 | C06 | O07 | 0.9° | 0.0° |
| N19 | C20 | H201 | H202 | 117.4° | 120.0° |
| N28 | C04 | N05 | C06 | 180.0° | 179.9° |
| C04 | N28 | C29 | H291 | 0.1° | 179.9° |
| C04 | N28 | C29 | H292 | 120.1° | 60.0° |
| C04 | N28 | C29 | H293 | 119.9° | 59.9° |
| C29 | N28 | C04 | N05 | 0.1° | 0.0° |
| N28 | C29 | H291 | H292 | 120.0° | 120.0° |
| N28 | C29 | H291 | H293 | 120.0° | 120.0° |
| N28 | C29 | H292 | H293 | 120.0° | 120.0° |
| N19 | C06 | N05 | C04 | 0.2° | 0.0° |
| N19 | C06 | N05 | O07 | 179.8° | 180.0° |
| N19 | C06 | O07 | C08 | 161.5° | 180.0° |
| C06 | N19 | C20 | H201 | 150.4° | 150.0° |
| C06 | N19 | C20 | H202 | 32.1° | 30.0° |
| C04 | N05 | C06 | O07 | 180.0° | 180.0° |
| N05 | C06 | O07 | C08 | 18.3° | 0.0° |
| C06 | O07 | C08 | C09 | 64.4° | 150.1° |
| C06 | O07 | C08 | C18 | 179.5° | 91.4° |
| C06 | O07 | C08 | H081 | 58.2° | 29.3° |
| O07 | C08 | C09 | C18 | 116.5° | 118.9° |
| O07 | C08 | C09 | H081 | 123.5° | 119.8° |
| O07 | C08 | C18 | H081 | 122.3° | 119.8° |
| O07 | C08 | C09 | C10 | 179.9° | 179.0° |
| O07 | C08 | C18 | C15 | 179.2° | 179.1° |
| O07 | C08 | C09 | H091 | 59.4° | 60.6° |
| O07 | C08 | C09 | H092 | 59.7° | 58.5° |
| O07 | C08 | C18 | H182 | 60.4° | 58.5° |
| O07 | C08 | C18 | H181 | 58.7° | 60.5° |
| C09 | C08 | C18 | H081 | 119.9° | 121.3° |
| C08 | C09 | C10 | H091 | 120.4° | 120.3° |
| C08 | C09 | C10 | H092 | 120.4° | 120.5° |
| C09 | C08 | C18 | C15 | 63.0° | 60.1° |
| C08 | C09 | C10 | C11 | 169.1° | 168.6° |
| C08 | C09 | C10 | C12 | 71.4° | 75.3° |
| C08 | C09 | C10 | N13 | 50.7° | 49.3° |
| C08 | C09 | H091 | H092 | 118.7° | 119.4° |
| C09 | C08 | C18 | H182 | 57.5° | 60.4° |
| C09 | C08 | C18 | H181 | 176.6° | 179.5° |
| C18 | C08 | C09 | C10 | 63.6° | 60.1° |
| C08 | C18 | C15 | H182 | 120.4° | 120.5° |
| C08 | C18 | C15 | H181 | 120.4° | 120.4° |
| C08 | C18 | C15 | N13 | 49.7° | 49.3° |
| C08 | C18 | C15 | C17 | 72.8° | 75.1° |
| C08 | C18 | C15 | C16 | 168.1° | 168.7° |
| C18 | C08 | C09 | H091 | 175.9° | 179.5° |
| C18 | C08 | C09 | H092 | 56.8° | 60.4° |
| C08 | C18 | H182 | H181 | 118.6° | 119.4° |
| C09 | C10 | C11 | C12 | 121.7° | 117.7° |
| C09 | C10 | C11 | N13 | 120.5° | 122.4° |
| C09 | C10 | C12 | N13 | 122.8° | 125.6° |
| C09 | C10 | N13 | C15 | 38.2° | 40.5° |
| C09 | C10 | N13 | O14 | 114.0° | 94.7° |
| C10 | C09 | C08 | H081 | 56.3° | 61.2° |
| C10 | C09 | H091 | H092 | 118.7° | 119.6° |
| C09 | C10 | C11 | H113 | 180.0° | 60.0° |
| C09 | C10 | C11 | H112 | 60.0° | 180.0° |
| C09 | C10 | C11 | H111 | 60.0° | 60.0° |
| C09 | C10 | C12 | H121 | 180.0° | 59.9° |
| C09 | C10 | C12 | H123 | 60.0° | 180.0° |
| C09 | C10 | C12 | H122 | 60.0° | 60.0° |
| C18 | C15 | N13 | C10 | 37.8° | 40.6° |
| C18 | C15 | N13 | C17 | 122.8° | 123.6° |
| C18 | C15 | N13 | C16 | 120.4° | 119.0° |
| C18 | C15 | C17 | C16 | 120.6° | 116.4° |
| C18 | C15 | N13 | O14 | 114.6° | 94.7° |
| C15 | C18 | C08 | H081 | 56.9° | 61.2° |
| C18 | C15 | C16 | H163 | 180.0° | 62.3° |
| C18 | C15 | C16 | H162 | 60.0° | 57.7° |
| C18 | C15 | C16 | H161 | 60.0° | 177.7° |
| C18 | C15 | C17 | H172 | 180.0° | 174.5° |
| C18 | C15 | C17 | H173 | 60.0° | 54.5° |
| C18 | C15 | C17 | H171 | 60.0° | 65.5° |
| C15 | C18 | H182 | H181 | 118.7° | 119.5° |
| C11 | C10 | C12 | N13 | 116.6° | 118.0° |
| C11 | C10 | N13 | C15 | 158.1° | 159.5° |
| C11 | C10 | N13 | O14 | 5.9° | 24.2° |
| C11 | C10 | C09 | H091 | 70.4° | 71.1° |
| C11 | C10 | C09 | H092 | 48.7° | 48.1° |
| C10 | C11 | H113 | H112 | 120.0° | 120.0° |
| C10 | C11 | H113 | H111 | 120.0° | 119.9° |
| C10 | C11 | H112 | H111 | 120.0° | 120.0° |
| C11 | C10 | C12 | H121 | 59.4° | 56.4° |
| C11 | C10 | C12 | H123 | 179.4° | 63.6° |
| C11 | C10 | C12 | H122 | 60.6° | 176.4° |
| C12 | C10 | N13 | C15 | 85.1° | 83.1° |
| C12 | C10 | N13 | O14 | 122.7° | 141.6° |
| C12 | C10 | C09 | H091 | 49.1° | 45.0° |
| C12 | C10 | C09 | H092 | 168.2° | 164.2° |
| C12 | C10 | C11 | H113 | 58.3° | 177.7° |
| C12 | C10 | C11 | H112 | 61.7° | 62.3° |
| C12 | C10 | C11 | H111 | 178.3° | 57.7° |
| C10 | C12 | H121 | H123 | 120.0° | 120.1° |
| C10 | C12 | H121 | H122 | 120.0° | 119.9° |
| C10 | C12 | H123 | H122 | 120.0° | 120.0° |
| C10 | N13 | C15 | O14 | 152.4° | 135.3° |
| C10 | N13 | C15 | C17 | 85.0° | 83.0° |
| C10 | N13 | C15 | C16 | 158.2° | 159.5° |
| N13 | C10 | C09 | H091 | 171.1° | 169.6° |
| N13 | C10 | C09 | H092 | 69.8° | 71.2° |
| N13 | C10 | C11 | H113 | 59.5° | 62.4° |
| N13 | C10 | C11 | H112 | 179.5° | 57.6° |
| N13 | C10 | C11 | H111 | 60.5° | 177.7° |
| N13 | C10 | C12 | H121 | 57.1° | 174.4° |
| N13 | C10 | C12 | H123 | 62.8° | 54.4° |
| N13 | C10 | C12 | H122 | 177.1° | 65.6° |
| C10 | N13 | O14 | H1 | 180.0° | 180.0° |
| N13 | C15 | C17 | C16 | 116.2° | 118.1° |
| N13 | C15 | C16 | H163 | 58.9° | 60.0° |
| N13 | C15 | C16 | H162 | 61.1° | 180.0° |
| N13 | C15 | C16 | H161 | 178.9° | 60.0° |
| N13 | C15 | C17 | H172 | 56.7° | 60.0° |
| N13 | C15 | C17 | H173 | 176.7° | 180.0° |
| N13 | C15 | C17 | H171 | 63.3° | 60.0° |
| N13 | C15 | C18 | H182 | 70.7° | 71.2° |
| N13 | C15 | C18 | H181 | 170.2° | 169.7° |
| C15 | N13 | O14 | H1 | 27.0° | 41.0° |
| C17 | C15 | N13 | O14 | 122.6° | 141.7° |
| C17 | C15 | C16 | H163 | 59.3° | 180.0° |
| C17 | C15 | C16 | H162 | 179.4° | 60.1° |
| C17 | C15 | C16 | H161 | 60.7° | 60.0° |
| C15 | C17 | H172 | H173 | 120.0° | 120.0° |
| C15 | C17 | H172 | H171 | 120.0° | 120.0° |
| C15 | C17 | H173 | H171 | 120.0° | 120.0° |
| C17 | C15 | C18 | H182 | 166.8° | 164.4° |
| C17 | C15 | C18 | H181 | 47.6° | 45.2° |
| C16 | C15 | N13 | O14 | 5.8° | 24.3° |
| C15 | C16 | H163 | H162 | 120.0° | 119.9° |
| C15 | C16 | H163 | H161 | 120.0° | 120.0° |
| C15 | C16 | H162 | H161 | 120.0° | 120.0° |
| C16 | C15 | C17 | H172 | 59.4° | 58.1° |
| C16 | C15 | C17 | H173 | 60.5° | 62.0° |
| C16 | C15 | C17 | H171 | 179.4° | 178.1° |
| C16 | C15 | C18 | H182 | 47.7° | 48.2° |
| C16 | C15 | C18 | H181 | 71.5° | 70.9° |
| H081 | C08 | C09 | H091 | 64.1° | 59.2° |
| H081 | C08 | C09 | H092 | 176.7° | 178.3° |
| H081 | C08 | C18 | H182 | 177.3° | 178.3° |
| H081 | C08 | C18 | H181 | 63.6° | 59.3° |
| H113 | C11 | H112 | H111 | 120.0° | 120.0° |
| H121 | C12 | H123 | H122 | 120.0° | 119.9° |
| H163 | C16 | H162 | H161 | 120.0° | 120.0° |
| H172 | C17 | H173 | H171 | 120.0° | 120.0° |
| H221 | C22 | C23 | H231 | 0.2° | 0.0° |
| H261 | C26 | C27 | H271 | 0.2° | 0.5° |
| H291 | C29 | H292 | H293 | 120.0° | 120.0° |
| H322 | C32 | C33 | H331 | 175.3° | 60.0° |
| H322 | C32 | C33 | H332 | 65.5° | 180.0° |
| H321 | C32 | C33 | H331 | 57.0° | 180.0° |
| H321 | C32 | C33 | H332 | 176.2° | 60.1° |
| H331 | C33 | C34 | H341 | 51.3° | 180.0° |
| H331 | C33 | C34 | H342 | 172.0° | 60.0° |
| H332 | C33 | C34 | H341 | 67.9° | 60.0° |
| H332 | C33 | C34 | H342 | 52.9° | 179.9° |
| H341 | C34 | O35 | H351 | 60.4° | 59.9° |
| H342 | C34 | O35 | H351 | 60.4° | 60.1° |
