C61
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | O3 | sing | 1.43Å | 1.41Å | |
| C2 | H2C1 | sing | 1.09Å | 1.10Å | |
| C2 | H2C2 | sing | 1.09Å | 1.10Å | |
| C2 | H2C3 | sing | 1.09Å | 1.10Å | |
| O3 | C4 | sing | 1.43Å | 1.42Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C4 | H4C1 | sing | 1.09Å | 1.10Å | |
| C4 | H4C2 | sing | 1.09Å | 1.10Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C5 | H5C1 | sing | 1.09Å | 1.10Å | |
| C5 | H5C2 | sing | 1.09Å | 1.10Å | |
| C6 | O7 | sing | 1.43Å | 1.42Å | |
| C6 | H6C1 | sing | 1.09Å | 1.10Å | |
| C6 | H6C2 | sing | 1.09Å | 1.10Å | |
| O7 | C11 | sing | 1.36Å | 1.44Å | |
| O8 | C9 | sing | 1.43Å | 1.46Å | |
| O8 | C12 | sing | 1.36Å | 1.43Å | |
| C9 | H9C1 | sing | 1.09Å | 1.10Å | |
| C9 | H9C2 | sing | 1.09Å | 1.10Å | |
| C9 | H9C3 | sing | 1.09Å | 1.10Å | |
| C10 | C11 | doub | 1.39Å | 1.41Å | Aromatic |
| C10 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C14 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | C16 | sing | 1.51Å | 1.52Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| C17 | C21 | sing | 1.53Å | 1.52Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | C19 | sing | 1.53Å | 1.37Å | |
| C18 | C20 | sing | 1.53Å | 1.50Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H203 | sing | 1.09Å | 1.10Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | N23 | sing | 1.47Å | 1.46Å | |
| C22 | C24 | sing | 1.53Å | 1.54Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| N23 | H231 | sing | 1.01Å | 1.00Å | |
| N23 | H232 | sing | 1.01Å | 1.00Å | |
| C24 | O25 | sing | 1.43Å | 1.45Å | |
| C24 | C26 | sing | 1.53Å | 1.53Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| O25 | H25 | sing | 0.97Å | 0.95Å | |
| C26 | C27 | sing | 1.53Å | 1.51Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C27 | C28 | sing | 1.53Å | 1.61Å | |
| C27 | C29 | sing | 1.51Å | 1.55Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | H281 | sing | 1.09Å | 1.10Å | |
| C28 | H282 | sing | 1.09Å | 1.10Å | |
| C28 | H283 | sing | 1.09Å | 1.10Å | |
| C29 | O30 | doub | 1.21Å | 1.24Å | |
| C29 | N31 | sing | 1.35Å | 1.32Å | |
| N31 | C32 | sing | 1.46Å | 1.44Å | |
| N31 | H31 | sing | 0.97Å | 1.00Å | |
| C32 | C33 | sing | 1.53Å | 1.48Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C33 | C34 | sing | 1.53Å | 1.54Å | |
| C33 | H331 | sing | 1.09Å | 1.10Å | |
| C33 | H332 | sing | 1.09Å | 1.10Å | |
| C34 | C35 | sing | 1.53Å | 1.55Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C35 | H353 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C2 | H2C1 | 109.5° | 109.5° |
| O3 | C2 | H2C2 | 109.5° | 109.5° |
| O3 | C2 | H2C3 | 109.4° | 109.5° |
| C2 | O3 | C4 | 107.4° | 114.0° |
| H2C1 | C2 | H2C2 | 109.5° | 109.5° |
| H2C1 | C2 | H2C3 | 109.5° | 109.4° |
| H2C2 | C2 | H2C3 | 109.5° | 109.5° |
| O3 | C4 | C5 | 108.3° | 109.5° |
| O3 | C4 | H4C1 | 109.8° | 109.5° |
| O3 | C4 | H4C2 | 110.1° | 109.5° |
| C5 | C4 | H4C1 | 109.9° | 109.5° |
| C5 | C4 | H4C2 | 110.1° | 109.4° |
| C4 | C5 | C6 | 108.9° | 109.5° |
| C4 | C5 | H5C1 | 109.7° | 109.4° |
| C4 | C5 | H5C2 | 109.8° | 109.5° |
| H4C1 | C4 | H4C2 | 108.6° | 109.4° |
| C6 | C5 | H5C1 | 109.7° | 109.5° |
| C6 | C5 | H5C2 | 109.8° | 109.5° |
| C5 | C6 | O7 | 110.7° | 109.5° |
| C5 | C6 | H6C1 | 109.1° | 109.5° |
| C5 | C6 | H6C2 | 108.8° | 109.5° |
| H5C1 | C5 | H5C2 | 109.0° | 109.4° |
| O7 | C6 | H6C1 | 109.1° | 109.5° |
| O7 | C6 | H6C2 | 108.8° | 109.4° |
| C6 | O7 | C11 | 109.7° | 117.0° |
| H6C1 | C6 | H6C2 | 110.4° | 109.4° |
| O7 | C11 | C10 | 119.0° | 120.1° |
| O7 | C11 | C12 | 120.5° | 120.1° |
| C9 | O8 | C12 | 123.6° | 117.0° |
| O8 | C9 | H9C1 | 109.5° | 109.5° |
| O8 | C9 | H9C2 | 109.5° | 109.5° |
| O8 | C9 | H9C3 | 109.4° | 109.5° |
| O8 | C12 | C11 | 120.4° | 120.1° |
| O8 | C12 | C13 | 120.1° | 120.1° |
| H9C1 | C9 | H9C2 | 109.4° | 109.5° |
| H9C1 | C9 | H9C3 | 109.5° | 109.5° |
| H9C2 | C9 | H9C3 | 109.5° | 109.5° |
| C11 | C10 | C15 | 120.2° | 120.0° |
| C11 | C10 | H10 | 119.9° | 120.0° |
| C10 | C11 | C12 | 120.5° | 119.8° |
| C15 | C10 | H10 | 119.9° | 120.0° |
| C10 | C15 | C14 | 119.6° | 120.2° |
| C10 | C15 | C16 | 118.2° | 119.9° |
| C11 | C12 | C13 | 119.5° | 119.9° |
| C12 | C13 | C14 | 120.1° | 120.0° |
| C12 | C13 | H13 | 119.9° | 120.0° |
| C14 | C13 | H13 | 120.0° | 120.0° |
| C13 | C14 | C15 | 120.2° | 120.1° |
| C13 | C14 | H14 | 119.9° | 120.0° |
| C15 | C14 | H14 | 119.9° | 119.9° |
| C14 | C15 | C16 | 122.1° | 119.9° |
| C15 | C16 | C17 | 107.7° | 109.5° |
| C15 | C16 | H161 | 110.1° | 109.5° |
| C15 | C16 | H162 | 110.4° | 109.5° |
| C17 | C16 | H161 | 110.1° | 109.4° |
| C17 | C16 | H162 | 110.5° | 109.4° |
| C16 | C17 | C18 | 108.1° | 109.5° |
| C16 | C17 | C21 | 108.7° | 109.5° |
| C16 | C17 | H17 | 111.9° | 109.4° |
| H161 | C16 | H162 | 108.1° | 109.4° |
| C18 | C17 | C21 | 112.3° | 109.5° |
| C18 | C17 | H17 | 108.3° | 109.5° |
| C17 | C18 | C19 | 105.2° | 109.5° |
| C17 | C18 | C20 | 109.1° | 109.5° |
| C17 | C18 | H18 | 113.6° | 109.5° |
| C21 | C17 | H17 | 107.7° | 109.4° |
| C17 | C21 | C22 | 109.7° | 109.5° |
| C17 | C21 | H211 | 109.4° | 109.5° |
| C17 | C21 | H212 | 109.4° | 109.4° |
| C19 | C18 | C20 | 112.4° | 109.5° |
| C19 | C18 | H18 | 110.3° | 109.4° |
| C18 | C19 | H191 | 109.5° | 109.4° |
| C18 | C19 | H192 | 109.4° | 109.5° |
| C18 | C19 | H193 | 109.5° | 109.5° |
| C20 | C18 | H18 | 106.5° | 109.5° |
| C18 | C20 | H201 | 109.5° | 109.5° |
| C18 | C20 | H202 | 109.5° | 109.5° |
| C18 | C20 | H203 | 109.5° | 109.5° |
| H191 | C19 | H192 | 109.5° | 109.5° |
| H191 | C19 | H193 | 109.5° | 109.4° |
| H192 | C19 | H193 | 109.5° | 109.5° |
| H201 | C20 | H202 | 109.5° | 109.5° |
| H201 | C20 | H203 | 109.4° | 109.4° |
| H202 | C20 | H203 | 109.5° | 109.5° |
| C22 | C21 | H211 | 109.4° | 109.5° |
| C22 | C21 | H212 | 109.4° | 109.4° |
| C21 | C22 | N23 | 109.4° | 109.5° |
| C21 | C22 | C24 | 109.6° | 109.5° |
| C21 | C22 | H22 | 109.5° | 109.5° |
| H211 | C21 | H212 | 109.6° | 109.5° |
| N23 | C22 | C24 | 109.6° | 109.5° |
| N23 | C22 | H22 | 109.4° | 109.5° |
| C22 | N23 | H231 | 109.5° | 111.0° |
| C22 | N23 | H232 | 109.4° | 111.0° |
| C24 | C22 | H22 | 109.2° | 109.4° |
| C22 | C24 | O25 | 111.4° | 109.5° |
| C22 | C24 | C26 | 111.8° | 109.5° |
| C22 | C24 | H24 | 106.3° | 109.5° |
| H231 | N23 | H232 | 109.5° | 111.0° |
| O25 | C24 | C26 | 109.0° | 109.5° |
| O25 | C24 | H24 | 109.3° | 109.4° |
| C24 | O25 | H25 | 109.5° | 114.0° |
| C26 | C24 | H24 | 108.9° | 109.5° |
| C24 | C26 | C27 | 106.8° | 109.5° |
| C24 | C26 | H261 | 110.4° | 109.5° |
| C24 | C26 | H262 | 110.9° | 109.4° |
| C27 | C26 | H261 | 110.4° | 109.4° |
| C27 | C26 | H262 | 110.9° | 109.5° |
| C26 | C27 | C28 | 110.1° | 109.5° |
| C26 | C27 | C29 | 113.9° | 109.4° |
| C26 | C27 | H27 | 105.1° | 109.5° |
| H261 | C26 | H262 | 107.4° | 109.5° |
| C28 | C27 | C29 | 106.6° | 109.5° |
| C28 | C27 | H27 | 112.6° | 109.5° |
| C27 | C28 | H281 | 109.5° | 109.4° |
| C27 | C28 | H282 | 109.5° | 109.5° |
| C27 | C28 | H283 | 109.5° | 109.5° |
| C29 | C27 | H27 | 108.7° | 109.5° |
| C27 | C29 | O30 | 121.8° | 120.0° |
| C27 | C29 | N31 | 115.9° | 120.0° |
| H281 | C28 | H282 | 109.5° | 109.5° |
| H281 | C28 | H283 | 109.5° | 109.5° |
| H282 | C28 | H283 | 109.5° | 109.5° |
| O30 | C29 | N31 | 122.2° | 120.0° |
| C29 | N31 | C32 | 122.9° | 120.0° |
| C29 | N31 | H31 | 118.6° | 120.0° |
| C32 | N31 | H31 | 118.6° | 120.0° |
| N31 | C32 | C33 | 118.4° | 109.5° |
| N31 | C32 | H321 | 106.6° | 109.4° |
| N31 | C32 | H322 | 104.5° | 109.5° |
| C33 | C32 | H321 | 106.6° | 109.5° |
| C33 | C32 | H322 | 104.6° | 109.5° |
| C32 | C33 | C34 | 110.5° | 109.5° |
| C32 | C33 | H331 | 109.1° | 109.5° |
| C32 | C33 | H332 | 108.9° | 109.5° |
| H321 | C32 | H322 | 116.7° | 109.5° |
| C34 | C33 | H331 | 109.1° | 109.5° |
| C34 | C33 | H332 | 108.9° | 109.4° |
| C33 | C34 | C35 | 111.0° | 109.5° |
| C33 | C34 | H341 | 108.9° | 109.5° |
| C33 | C34 | H342 | 108.6° | 109.5° |
| H331 | C33 | H332 | 110.3° | 109.5° |
| C35 | C34 | H341 | 109.0° | 109.4° |
| C35 | C34 | H342 | 108.6° | 109.5° |
| C34 | C35 | H351 | 109.5° | 109.4° |
| C34 | C35 | H352 | 109.4° | 109.4° |
| C34 | C35 | H353 | 109.5° | 109.5° |
| H341 | C34 | H342 | 110.7° | 109.4° |
| H351 | C35 | H352 | 109.5° | 109.5° |
| H351 | C35 | H353 | 109.5° | 109.4° |
| H352 | C35 | H353 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C2 | H2C1 | H2C2 | 120.0° | 120.0° |
| O3 | C2 | H2C1 | H2C3 | 120.0° | 120.0° |
| O3 | C2 | H2C2 | H2C3 | 120.0° | 120.0° |
| C2 | O3 | C4 | C5 | 154.5° | 180.0° |
| C2 | O3 | C4 | H4C1 | 85.5° | 59.9° |
| C2 | O3 | C4 | H4C2 | 34.1° | 60.0° |
| H2C1 | C2 | H2C2 | H2C3 | 120.0° | 120.0° |
| H2C1 | C2 | O3 | C4 | 84.5° | 60.0° |
| H2C2 | C2 | O3 | C4 | 155.5° | 180.0° |
| H2C3 | C2 | O3 | C4 | 35.5° | 60.0° |
| O3 | C4 | C5 | H4C1 | 120.0° | 120.1° |
| O3 | C4 | C5 | H4C2 | 120.5° | 120.0° |
| O3 | C4 | H4C1 | H4C2 | 120.5° | 120.0° |
| O3 | C4 | C5 | C6 | 158.2° | 180.0° |
| O3 | C4 | C5 | H5C1 | 81.7° | 59.9° |
| O3 | C4 | C5 | H5C2 | 38.0° | 60.0° |
| C5 | C4 | H4C1 | H4C2 | 120.5° | 119.9° |
| C4 | C5 | C6 | H5C1 | 120.0° | 120.0° |
| C4 | C5 | C6 | H5C2 | 120.2° | 120.0° |
| C4 | C5 | H5C1 | H5C2 | 120.2° | 120.0° |
| C4 | C5 | C6 | O7 | 174.4° | 180.0° |
| C4 | C5 | C6 | H6C1 | 54.4° | 60.0° |
| C4 | C5 | C6 | H6C2 | 66.1° | 60.0° |
| H4C1 | C4 | C5 | C6 | 38.3° | 59.9° |
| H4C1 | C4 | C5 | H5C1 | 158.3° | 180.0° |
| H4C1 | C4 | C5 | H5C2 | 82.0° | 60.1° |
| H4C2 | C4 | C5 | C6 | 81.3° | 60.0° |
| H4C2 | C4 | C5 | H5C1 | 38.7° | 60.0° |
| H4C2 | C4 | C5 | H5C2 | 158.5° | 180.0° |
| C6 | C5 | H5C1 | H5C2 | 120.2° | 120.0° |
| C5 | C6 | O7 | H6C1 | 120.0° | 120.1° |
| C5 | C6 | O7 | H6C2 | 119.5° | 120.0° |
| C5 | C6 | H6C1 | H6C2 | 119.5° | 120.0° |
| C5 | C6 | O7 | C11 | 173.2° | 180.0° |
| H5C1 | C5 | C6 | O7 | 65.6° | 60.0° |
| H5C1 | C5 | C6 | H6C1 | 174.4° | 180.0° |
| H5C1 | C5 | C6 | H6C2 | 53.9° | 60.0° |
| H5C2 | C5 | C6 | O7 | 54.1° | 60.0° |
| H5C2 | C5 | C6 | H6C1 | 65.9° | 60.0° |
| H5C2 | C5 | C6 | H6C2 | 173.6° | 180.0° |
| O7 | C6 | H6C1 | H6C2 | 119.5° | 119.9° |
| C6 | O7 | C11 | C10 | 20.0° | 0.1° |
| C6 | O7 | C11 | C12 | 161.5° | 180.0° |
| H6C1 | C6 | O7 | C11 | 53.2° | 59.9° |
| H6C2 | C6 | O7 | C11 | 67.3° | 60.0° |
| O7 | C11 | C12 | O8 | 1.3° | 0.0° |
| O7 | C11 | C10 | C12 | 178.5° | 180.0° |
| O7 | C11 | C10 | C15 | 178.6° | 180.0° |
| O7 | C11 | C10 | H10 | 1.4° | 0.3° |
| O7 | C11 | C12 | C13 | 178.8° | 179.9° |
| O8 | C9 | H9C1 | H9C2 | 120.0° | 120.0° |
| O8 | C9 | H9C1 | H9C3 | 120.0° | 120.0° |
| O8 | C9 | H9C2 | H9C3 | 120.0° | 120.0° |
| C9 | O8 | C12 | C11 | 124.0° | 180.0° |
| C9 | O8 | C12 | C13 | 56.2° | 0.0° |
| C12 | O8 | C9 | H9C1 | 85.4° | 60.0° |
| C12 | O8 | C9 | H9C2 | 154.6° | 60.0° |
| C12 | O8 | C9 | H9C3 | 34.5° | 180.0° |
| O8 | C12 | C11 | C10 | 179.7° | 179.9° |
| O8 | C12 | C11 | C13 | 179.9° | 179.9° |
| O8 | C12 | C13 | C14 | 179.7° | 179.9° |
| O8 | C12 | C13 | H13 | 0.3° | 0.0° |
| H9C1 | C9 | H9C2 | H9C3 | 120.0° | 120.0° |
| C11 | C10 | C15 | H10 | 180.0° | 179.7° |
| C10 | C11 | C12 | C13 | 0.4° | 0.0° |
| C11 | C10 | C15 | C14 | 0.6° | 0.1° |
| C11 | C10 | C15 | C16 | 178.9° | 180.0° |
| C15 | C10 | C11 | C12 | 0.1° | 0.0° |
| C10 | C15 | C14 | C13 | 1.2° | 0.1° |
| C10 | C15 | C14 | C16 | 178.2° | 179.9° |
| C10 | C15 | C14 | H14 | 178.8° | 180.0° |
| C10 | C15 | C16 | C17 | 45.1° | 121.5° |
| C10 | C15 | C16 | H161 | 74.9° | 118.5° |
| C10 | C15 | C16 | H162 | 165.9° | 1.5° |
| H10 | C10 | C11 | C12 | 179.9° | 179.7° |
| H10 | C10 | C15 | C14 | 179.4° | 179.8° |
| H10 | C10 | C15 | C16 | 1.0° | 0.3° |
| C11 | C12 | C13 | C14 | 0.2° | 0.0° |
| C11 | C12 | C13 | H13 | 179.8° | 179.9° |
| C12 | C13 | C14 | H13 | 180.0° | 179.9° |
| C12 | C13 | C14 | C15 | 1.0° | 0.0° |
| C12 | C13 | C14 | H14 | 179.0° | 180.0° |
| C13 | C14 | C15 | H14 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 179.4° | 180.0° |
| H13 | C13 | C14 | C15 | 179.0° | 180.0° |
| H13 | C13 | C14 | H14 | 1.0° | 0.1° |
| C14 | C15 | C16 | C17 | 133.1° | 58.4° |
| C14 | C15 | C16 | H161 | 106.9° | 61.6° |
| C14 | C15 | C16 | H162 | 12.4° | 178.4° |
| H14 | C14 | C15 | C16 | 0.6° | 0.0° |
| C15 | C16 | C17 | H161 | 120.0° | 120.0° |
| C15 | C16 | C17 | H162 | 120.7° | 120.1° |
| C15 | C16 | H161 | H162 | 120.7° | 120.1° |
| C15 | C16 | C17 | C18 | 84.8° | 75.8° |
| C15 | C16 | C17 | C21 | 153.0° | 164.1° |
| C15 | C16 | C17 | H17 | 34.3° | 44.2° |
| C17 | C16 | H161 | H162 | 120.8° | 119.9° |
| C16 | C17 | C18 | C21 | 119.9° | 120.0° |
| C16 | C17 | C18 | H17 | 121.4° | 120.0° |
| C16 | C17 | C21 | H17 | 121.4° | 119.9° |
| C16 | C17 | C18 | C19 | 178.1° | 53.8° |
| C16 | C17 | C18 | C20 | 61.1° | 66.2° |
| C16 | C17 | C18 | H18 | 57.4° | 173.7° |
| C16 | C17 | C21 | C22 | 37.2° | 173.4° |
| C16 | C17 | C21 | H211 | 82.8° | 53.4° |
| C16 | C17 | C21 | H212 | 157.1° | 66.6° |
| H161 | C16 | C17 | C18 | 155.2° | 164.2° |
| H161 | C16 | C17 | C21 | 33.0° | 44.1° |
| H161 | C16 | C17 | H17 | 85.7° | 75.9° |
| H162 | C16 | C17 | C18 | 35.9° | 44.2° |
| H162 | C16 | C17 | C21 | 86.3° | 75.8° |
| H162 | C16 | C17 | H17 | 155.0° | 164.2° |
| C18 | C17 | C21 | H17 | 119.1° | 120.0° |
| C17 | C18 | C19 | C20 | 118.5° | 120.1° |
| C17 | C18 | C19 | H18 | 122.8° | 120.0° |
| C17 | C18 | C20 | H18 | 122.9° | 120.0° |
| C17 | C18 | C19 | H191 | 93.8° | 62.9° |
| C17 | C18 | C19 | H192 | 146.2° | 177.1° |
| C17 | C18 | C19 | H193 | 26.2° | 57.0° |
| C17 | C18 | C20 | H201 | 51.3° | 54.0° |
| C17 | C18 | C20 | H202 | 171.3° | 174.0° |
| C17 | C18 | C20 | H203 | 68.7° | 66.0° |
| C18 | C17 | C21 | C22 | 156.8° | 66.5° |
| C18 | C17 | C21 | H211 | 36.8° | 173.4° |
| C18 | C17 | C21 | H212 | 83.3° | 53.4° |
| C21 | C17 | C18 | C19 | 62.0° | 66.2° |
| C21 | C17 | C18 | C20 | 58.8° | 173.7° |
| C21 | C17 | C18 | H18 | 177.3° | 53.7° |
| C17 | C21 | C22 | H211 | 120.0° | 120.1° |
| C17 | C21 | C22 | H212 | 119.9° | 119.9° |
| C17 | C21 | H211 | H212 | 119.9° | 120.0° |
| C17 | C21 | C22 | N23 | 71.0° | 68.6° |
| C17 | C21 | C22 | C24 | 168.7° | 171.4° |
| C17 | C21 | C22 | H22 | 48.9° | 51.5° |
| H17 | C17 | C18 | C19 | 56.7° | 173.8° |
| H17 | C17 | C18 | C20 | 177.5° | 53.7° |
| H17 | C17 | C18 | H18 | 64.0° | 66.3° |
| H17 | C17 | C21 | C22 | 84.2° | 53.5° |
| H17 | C17 | C21 | H211 | 155.8° | 66.6° |
| H17 | C17 | C21 | H212 | 35.7° | 173.4° |
| C19 | C18 | C20 | H18 | 120.9° | 119.9° |
| C18 | C19 | H191 | H192 | 120.0° | 120.0° |
| C18 | C19 | H191 | H193 | 120.0° | 119.9° |
| C18 | C19 | H192 | H193 | 120.0° | 120.0° |
| C19 | C18 | C20 | H201 | 167.5° | 174.0° |
| C19 | C18 | C20 | H202 | 72.5° | 65.9° |
| C19 | C18 | C20 | H203 | 47.5° | 54.1° |
| C20 | C18 | C19 | H191 | 24.7° | 57.2° |
| C20 | C18 | C19 | H192 | 95.3° | 62.9° |
| C20 | C18 | C19 | H193 | 144.7° | 177.1° |
| C18 | C20 | H201 | H202 | 120.0° | 120.0° |
| C18 | C20 | H201 | H203 | 120.0° | 120.0° |
| C18 | C20 | H202 | H203 | 120.0° | 120.0° |
| H18 | C18 | C19 | H191 | 143.4° | 177.2° |
| H18 | C18 | C19 | H192 | 23.4° | 57.1° |
| H18 | C18 | C19 | H193 | 96.6° | 62.9° |
| H18 | C18 | C20 | H201 | 71.6° | 66.0° |
| H18 | C18 | C20 | H202 | 48.4° | 54.0° |
| H18 | C18 | C20 | H203 | 168.4° | 174.0° |
| H191 | C19 | H192 | H193 | 120.0° | 120.0° |
| H201 | C20 | H202 | H203 | 120.0° | 120.0° |
| C22 | C21 | H211 | H212 | 119.9° | 120.0° |
| C21 | C22 | N23 | C24 | 120.3° | 120.0° |
| C21 | C22 | N23 | H22 | 119.9° | 120.0° |
| C21 | C22 | C24 | H22 | 119.9° | 120.0° |
| C21 | C22 | N23 | H231 | 74.2° | 179.7° |
| C21 | C22 | N23 | H232 | 45.8° | 56.3° |
| C21 | C22 | C24 | O25 | 64.4° | 60.0° |
| C21 | C22 | C24 | C26 | 173.4° | 180.0° |
| C21 | C22 | C24 | H24 | 54.6° | 59.9° |
| H211 | C21 | C22 | N23 | 169.0° | 171.4° |
| H211 | C21 | C22 | C24 | 48.7° | 51.4° |
| H211 | C21 | C22 | H22 | 71.1° | 68.6° |
| H212 | C21 | C22 | N23 | 48.9° | 51.3° |
| H212 | C21 | C22 | C24 | 71.4° | 68.7° |
| H212 | C21 | C22 | H22 | 168.9° | 171.4° |
| N23 | C22 | C24 | H22 | 119.9° | 120.0° |
| C22 | N23 | H231 | H232 | 120.0° | 124.0° |
| N23 | C22 | C24 | O25 | 55.8° | 60.0° |
| N23 | C22 | C24 | C26 | 66.4° | 60.0° |
| N23 | C22 | C24 | H24 | 174.8° | 180.0° |
| C24 | C22 | N23 | H231 | 46.1° | 60.3° |
| C24 | C22 | N23 | H232 | 166.1° | 63.7° |
| C22 | C24 | O25 | C26 | 123.8° | 120.0° |
| C22 | C24 | O25 | H24 | 117.2° | 120.0° |
| C22 | C24 | C26 | H24 | 117.2° | 120.0° |
| C22 | C24 | O25 | H25 | 89.4° | 60.0° |
| C22 | C24 | C26 | C27 | 170.3° | 173.3° |
| C22 | C24 | C26 | H261 | 50.3° | 66.7° |
| C22 | C24 | C26 | H262 | 68.7° | 53.3° |
| H22 | C22 | N23 | H231 | 165.9° | 59.6° |
| H22 | C22 | N23 | H232 | 74.1° | 176.4° |
| H22 | C22 | C24 | O25 | 175.7° | 180.0° |
| H22 | C22 | C24 | C26 | 53.5° | 60.0° |
| H22 | C22 | C24 | H24 | 65.3° | 60.1° |
| O25 | C24 | C26 | H24 | 119.2° | 120.0° |
| O25 | C24 | C26 | C27 | 46.7° | 66.7° |
| O25 | C24 | C26 | H261 | 73.3° | 53.2° |
| O25 | C24 | C26 | H262 | 167.7° | 173.3° |
| C26 | C24 | O25 | H25 | 146.8° | 60.0° |
| C24 | C26 | C27 | H261 | 120.0° | 120.0° |
| C24 | C26 | C27 | H262 | 121.0° | 120.0° |
| C24 | C26 | H261 | H262 | 121.1° | 120.0° |
| C24 | C26 | C27 | C28 | 165.8° | 173.3° |
| C24 | C26 | C27 | C29 | 74.4° | 66.8° |
| C24 | C26 | C27 | H27 | 44.4° | 53.2° |
| H24 | C24 | O25 | H25 | 27.9° | 180.0° |
| H24 | C24 | C26 | C27 | 72.5° | 53.2° |
| H24 | C24 | C26 | H261 | 167.5° | 173.2° |
| H24 | C24 | C26 | H262 | 48.6° | 66.7° |
| C27 | C26 | H261 | H262 | 121.1° | 120.0° |
| C26 | C27 | C28 | C29 | 124.0° | 120.0° |
| C26 | C27 | C28 | H27 | 116.9° | 120.0° |
| C26 | C27 | C29 | H27 | 116.7° | 120.0° |
| C26 | C27 | C28 | H281 | 147.2° | 55.1° |
| C26 | C27 | C28 | H282 | 27.2° | 65.0° |
| C26 | C27 | C28 | H283 | 92.8° | 175.0° |
| C26 | C27 | C29 | O30 | 59.1° | 0.0° |
| C26 | C27 | C29 | N31 | 123.6° | 180.0° |
| H261 | C26 | C27 | C28 | 45.8° | 53.2° |
| H261 | C26 | C27 | C29 | 165.5° | 173.2° |
| H261 | C26 | C27 | H27 | 75.7° | 66.8° |
| H262 | C26 | C27 | C28 | 73.2° | 66.8° |
| H262 | C26 | C27 | C29 | 46.6° | 53.2° |
| H262 | C26 | C27 | H27 | 165.4° | 173.2° |
| C28 | C27 | C29 | H27 | 121.6° | 120.0° |
| C27 | C28 | H281 | H282 | 120.0° | 120.0° |
| C27 | C28 | H281 | H283 | 120.0° | 120.0° |
| C27 | C28 | H282 | H283 | 120.0° | 120.0° |
| C28 | C27 | C29 | O30 | 62.6° | 120.0° |
| C28 | C27 | C29 | N31 | 114.7° | 60.0° |
| C29 | C27 | C28 | H281 | 88.7° | 175.0° |
| C29 | C27 | C28 | H282 | 151.3° | 55.0° |
| C29 | C27 | C28 | H283 | 31.3° | 65.0° |
| C27 | C29 | O30 | N31 | 177.1° | 180.0° |
| C27 | C29 | N31 | C32 | 174.3° | 180.0° |
| C27 | C29 | N31 | H31 | 5.8° | 0.0° |
| H27 | C27 | C28 | H281 | 30.3° | 65.0° |
| H27 | C27 | C28 | H282 | 89.7° | 175.0° |
| H27 | C27 | C28 | H283 | 150.3° | 55.0° |
| H27 | C27 | C29 | O30 | 175.8° | 120.0° |
| H27 | C27 | C29 | N31 | 6.9° | 60.0° |
| H281 | C28 | H282 | H283 | 120.0° | 120.0° |
| O30 | C29 | N31 | C32 | 3.0° | 0.1° |
| O30 | C29 | N31 | H31 | 177.0° | 180.0° |
| C29 | N31 | C32 | H31 | 180.0° | 179.9° |
| C29 | N31 | C32 | C33 | 61.0° | 180.0° |
| C29 | N31 | C32 | H321 | 179.0° | 60.1° |
| C29 | N31 | C32 | H322 | 54.8° | 60.0° |
| N31 | C32 | C33 | H321 | 120.0° | 119.9° |
| N31 | C32 | C33 | H322 | 115.8° | 120.0° |
| N31 | C32 | H321 | H322 | 116.3° | 120.0° |
| N31 | C32 | C33 | C34 | 177.5° | 179.9° |
| N31 | C32 | C33 | H331 | 62.5° | 60.0° |
| N31 | C32 | C33 | H332 | 57.9° | 60.0° |
| H31 | N31 | C32 | C33 | 119.0° | 0.1° |
| H31 | N31 | C32 | H321 | 1.0° | 120.0° |
| H31 | N31 | C32 | H322 | 125.2° | 120.0° |
| C33 | C32 | H321 | H322 | 116.4° | 120.0° |
| C32 | C33 | C34 | H331 | 120.0° | 120.0° |
| C32 | C33 | C34 | H332 | 119.6° | 120.0° |
| C32 | C33 | H331 | H332 | 119.6° | 120.0° |
| C32 | C33 | C34 | C35 | 144.3° | 180.0° |
| C32 | C33 | C34 | H341 | 24.3° | 60.0° |
| C32 | C33 | C34 | H342 | 96.4° | 60.0° |
| H321 | C32 | C33 | C34 | 57.5° | 60.0° |
| H321 | C32 | C33 | H331 | 177.5° | 180.0° |
| H321 | C32 | C33 | H332 | 62.1° | 59.9° |
| H322 | C32 | C33 | C34 | 66.7° | 60.0° |
| H322 | C32 | C33 | H331 | 53.3° | 60.0° |
| H322 | C32 | C33 | H332 | 173.7° | 180.0° |
| C34 | C33 | H331 | H332 | 119.6° | 120.0° |
| C33 | C34 | C35 | H341 | 120.0° | 120.0° |
| C33 | C34 | C35 | H342 | 119.3° | 120.0° |
| C33 | C34 | H341 | H342 | 119.4° | 120.0° |
| C33 | C34 | C35 | H351 | 62.5° | 60.0° |
| C33 | C34 | C35 | H352 | 57.5° | 60.0° |
| C33 | C34 | C35 | H353 | 177.5° | 180.0° |
| H331 | C33 | C34 | C35 | 95.7° | 60.0° |
| H331 | C33 | C34 | H341 | 144.3° | 180.0° |
| H331 | C33 | C34 | H342 | 23.6° | 60.0° |
| H332 | C33 | C34 | C35 | 24.7° | 60.0° |
| H332 | C33 | C34 | H341 | 95.3° | 60.0° |
| H332 | C33 | C34 | H342 | 144.0° | 180.0° |
| C35 | C34 | H341 | H342 | 119.4° | 120.0° |
| C34 | C35 | H351 | H352 | 120.0° | 119.9° |
| C34 | C35 | H351 | H353 | 120.0° | 120.0° |
| C34 | C35 | H352 | H353 | 120.0° | 120.1° |
| H341 | C34 | C35 | H351 | 177.5° | 180.0° |
| H341 | C34 | C35 | H352 | 62.5° | 60.1° |
| H341 | C34 | C35 | H353 | 57.5° | 60.0° |
| H342 | C34 | C35 | H351 | 56.8° | 60.0° |
| H342 | C34 | C35 | H352 | 176.8° | 180.0° |
| H342 | C34 | C35 | H353 | 63.2° | 59.9° |
| H351 | C35 | H352 | H353 | 120.0° | 120.0° |
