MFN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.47Å | 1.48Å | |
| C1 | N1 | sing | 1.45Å | 1.48Å | |
| C1 | H11A | sing | 1.11Å | 1.10Å | |
| C1 | H12A | sing | 1.11Å | 1.10Å | |
| O1 | C2 | sing | 1.36Å | 1.42Å | Aromatic |
| O1 | C5 | sing | 1.36Å | 1.34Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.33Å | Aromatic |
| O2 | C9 | sing | 1.36Å | 1.35Å | |
| O2 | C13 | sing | 1.43Å | 1.46Å | |
| C3 | C4 | sing | 1.40Å | 1.43Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| O3 | C16 | doub | 1.23Å | 1.25Å | |
| C4 | C5 | doub | 1.36Å | 1.37Å | Aromatic |
| C4 | C13 | sing | 1.50Å | 1.44Å | |
| O4 | C20 | doub | 1.22Å | 1.35Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| O5 | C20 | sing | 1.36Å | 1.23Å | |
| O5 | HO5 | sing | 0.98Å | 0.95Å | |
| C6 | C12 | sing | 1.51Å | 1.56Å | |
| C6 | C11 | doub | 1.39Å | 1.41Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.41Å | Aromatic |
| N3 | C21 | sing | 1.39Å | 1.36Å | |
| N3 | C19 | sing | 1.44Å | 1.50Å | |
| N3 | HN3 | sing | 1.02Å | 1.00Å | |
| C21 | O6 | doub | 1.23Å | 1.27Å | |
| C21 | C22 | sing | 1.52Å | 1.57Å | |
| C22 | C14 | sing | 1.53Å | 1.56Å | |
| C22 | H221 | sing | 1.10Å | 1.10Å | |
| C22 | H222 | sing | 1.10Å | 1.10Å | |
| C14 | C23 | sing | 1.53Å | 1.56Å | |
| C14 | H141 | sing | 1.10Å | 1.10Å | |
| C14 | H142 | sing | 1.10Å | 1.10Å | |
| C23 | C24 | sing | 1.52Å | 1.55Å | |
| C23 | N4 | sing | 1.45Å | 1.48Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | O7 | sing | 1.36Å | 1.35Å | |
| C24 | O8 | doub | 1.22Å | 1.23Å | |
| O7 | HO7 | sing | 0.98Å | 0.95Å | |
| N4 | C25 | sing | 1.38Å | 1.33Å | |
| N4 | HN4 | sing | 1.02Å | 1.00Å | |
| C25 | O9 | doub | 1.23Å | 1.23Å | |
| C25 | C26 | sing | 1.52Å | 1.55Å | |
| C26 | C27 | sing | 1.53Å | 1.56Å | |
| C26 | H261 | sing | 1.10Å | 1.10Å | |
| C26 | H262 | sing | 1.10Å | 1.10Å | |
| C27 | C28 | sing | 1.54Å | 1.56Å | |
| C27 | H271 | sing | 1.10Å | 1.10Å | |
| C27 | H272 | sing | 1.10Å | 1.10Å | |
| C28 | C29 | sing | 1.53Å | 1.56Å | |
| C28 | C33 | sing | 1.55Å | 99.92Å | |
| C28 | H282 | sing | 1.10Å | 1.10Å | |
| C29 | O10 | sing | 1.36Å | 1.36Å | |
| C29 | O11 | doub | 1.22Å | 1.25Å | |
| O10 | HO10 | sing | 0.98Å | 0.95Å | |
| C19 | C20 | sing | 1.52Å | 1.53Å | |
| C19 | C18 | sing | 1.53Å | 1.57Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | C17 | sing | 1.52Å | 1.57Å | |
| C16 | N2 | sing | 1.39Å | 1.37Å | |
| C17 | C18 | sing | 1.53Å | 1.55Å | |
| C17 | H171 | sing | 1.10Å | 1.10Å | |
| C17 | H172 | sing | 1.10Å | 1.10Å | |
| C18 | H181 | sing | 1.10Å | 1.10Å | |
| C18 | H182 | sing | 1.10Å | 1.10Å | |
| N2 | C15 | sing | 1.44Å | 1.51Å | |
| N2 | HN2 | sing | 1.02Å | 1.00Å | |
| C15 | C12 | sing | 1.53Å | 1.57Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C12 | H121 | sing | 1.10Å | 1.10Å | |
| C12 | H122 | sing | 1.10Å | 1.10Å | |
| C11 | C10 | sing | 1.40Å | 1.41Å | Aromatic |
| C11 | H11 | sing | 1.09Å | 1.08Å | |
| C10 | C9 | doub | 1.40Å | 1.40Å | Aromatic |
| C10 | H10 | sing | 1.09Å | 1.08Å | |
| C7 | C8 | doub | 1.40Å | 1.42Å | Aromatic |
| C7 | H7 | sing | 1.09Å | 1.08Å | |
| C8 | C9 | sing | 1.40Å | 1.41Å | Aromatic |
| C8 | H8 | sing | 1.09Å | 1.08Å | |
| C13 | H131 | sing | 1.10Å | 1.10Å | |
| C13 | H132 | sing | 1.10Å | 1.10Å | |
| N1 | C35 | sing | 1.37Å | 94.44Å | |
| N1 | HN11 | sing | 1.01Å | 1.00Å | |
| O12 | C30 | sing | 1.36Å | 0.00Å | |
| O12 | H12 | sing | 0.98Å | 0.00Å | |
| C30 | O13 | doub | 1.22Å | 0.00Å | |
| C30 | C31 | sing | 1.51Å | 0.00Å | |
| C31 | C32 | sing | 1.53Å | 0.00Å | |
| C31 | H311 | sing | 1.10Å | 0.00Å | |
| C31 | H312 | sing | 1.09Å | 0.00Å | |
| C32 | C33 | sing | 1.54Å | 0.00Å | |
| C32 | H321 | sing | 1.10Å | 0.00Å | |
| C32 | H322 | sing | 1.10Å | 0.00Å | |
| C33 | C34 | sing | 1.53Å | 0.00Å | |
| C33 | H33 | sing | 1.10Å | 0.00Å | |
| C34 | O14 | doub | 1.22Å | 0.00Å | |
| C34 | O15 | sing | 1.36Å | 0.00Å | |
| O15 | H15 | sing | 0.98Å | 0.00Å | |
| C35 | O16 | doub | 1.22Å | 0.00Å | |
| C35 | H35 | sing | 1.10Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | N1 | 108.9° | 113.1° |
| C2 | C1 | H11A | 109.7° | 112.2° |
| C2 | C1 | H12A | 109.8° | 112.6° |
| C1 | C2 | O1 | 123.5° | 116.3° |
| C1 | C2 | C3 | 124.2° | 133.2° |
| N1 | C1 | H11A | 109.7° | 106.4° |
| N1 | C1 | H12A | 109.8° | 106.3° |
| C1 | N1 | C35 | 108.4° | 123.2° |
| C1 | N1 | HN11 | 125.8° | 118.4° |
| H11A | C1 | H12A | 109.0° | 105.7° |
| C2 | O1 | C5 | 104.8° | 106.6° |
| O1 | C2 | C3 | 112.3° | 110.6° |
| O1 | C5 | C4 | 110.0° | 109.7° |
| O1 | C5 | H5 | 125.0° | 115.5° |
| C2 | C3 | C4 | 104.3° | 105.2° |
| C2 | C3 | H3 | 127.8° | 126.2° |
| C9 | O2 | C13 | 119.1° | 117.1° |
| O2 | C9 | C10 | 119.0° | 120.0° |
| O2 | C9 | C8 | 122.9° | 120.0° |
| O2 | C13 | C4 | 108.8° | 109.1° |
| O2 | C13 | H131 | 109.7° | 109.0° |
| O2 | C13 | H132 | 109.9° | 109.1° |
| C4 | C3 | H3 | 127.8° | 128.6° |
| C3 | C4 | C5 | 108.4° | 107.9° |
| C3 | C4 | C13 | 126.4° | 126.1° |
| O3 | C16 | C17 | 117.3° | 123.3° |
| O3 | C16 | N2 | 119.2° | 125.1° |
| C5 | C4 | C13 | 125.1° | 126.0° |
| C4 | C5 | H5 | 125.0° | 134.8° |
| C4 | C13 | H131 | 109.7° | 111.0° |
| C4 | C13 | H132 | 109.8° | 110.7° |
| O4 | C20 | O5 | 119.2° | 122.8° |
| O4 | C20 | C19 | 121.6° | 125.3° |
| C20 | O5 | HO5 | 109.5° | 115.3° |
| O5 | C20 | C19 | 119.2° | 111.9° |
| C12 | C6 | C11 | 116.4° | 119.4° |
| C12 | C6 | C7 | 125.3° | 119.4° |
| C6 | C12 | C15 | 120.0° | 113.0° |
| C6 | C12 | H121 | 106.1° | 108.5° |
| C6 | C12 | H122 | 103.7° | 109.8° |
| C11 | C6 | C7 | 118.3° | 121.3° |
| C6 | C11 | C10 | 121.6° | 119.4° |
| C6 | C11 | H11 | 119.2° | 121.2° |
| C6 | C7 | C8 | 119.7° | 119.4° |
| C6 | C7 | H7 | 120.2° | 121.1° |
| C21 | N3 | C19 | 114.2° | 122.7° |
| C21 | N3 | HN3 | 122.9° | 118.6° |
| N3 | C21 | O6 | 113.8° | 125.0° |
| N3 | C21 | C22 | 131.5° | 111.7° |
| C19 | N3 | HN3 | 122.9° | 118.7° |
| N3 | C19 | C20 | 103.0° | 106.5° |
| N3 | C19 | C18 | 126.7° | 112.4° |
| N3 | C19 | H19 | 100.5° | 106.0° |
| O6 | C21 | C22 | 114.5° | 123.3° |
| C21 | C22 | C14 | 111.9° | 113.6° |
| C21 | C22 | H221 | 108.7° | 109.4° |
| C21 | C22 | H222 | 108.1° | 106.9° |
| C14 | C22 | H221 | 108.7° | 110.7° |
| C14 | C22 | H222 | 108.2° | 108.7° |
| C22 | C14 | C23 | 114.9° | 113.4° |
| C22 | C14 | H141 | 107.7° | 108.4° |
| C22 | C14 | H142 | 106.5° | 109.6° |
| H221 | C22 | H222 | 111.3° | 107.3° |
| C23 | C14 | H141 | 107.7° | 109.3° |
| C23 | C14 | H142 | 106.4° | 109.8° |
| C14 | C23 | C24 | 111.1° | 110.2° |
| C14 | C23 | N4 | 113.4° | 112.4° |
| C14 | C23 | H23 | 104.6° | 112.2° |
| H141 | C14 | H142 | 113.9° | 106.2° |
| C24 | C23 | N4 | 106.2° | 106.6° |
| C24 | C23 | H23 | 112.0° | 109.1° |
| C23 | C24 | O7 | 121.9° | 111.9° |
| C23 | C24 | O8 | 121.6° | 125.2° |
| N4 | C23 | H23 | 109.7° | 106.0° |
| C23 | N4 | C25 | 122.0° | 123.2° |
| C23 | N4 | HN4 | 119.0° | 118.3° |
| O7 | C24 | O8 | 116.5° | 122.8° |
| C24 | O7 | HO7 | 109.5° | 115.3° |
| C25 | N4 | HN4 | 119.0° | 118.4° |
| N4 | C25 | O9 | 118.8° | 125.6° |
| N4 | C25 | C26 | 118.2° | 112.9° |
| O9 | C25 | C26 | 118.2° | 121.5° |
| C25 | C26 | C27 | 112.5° | 112.7° |
| C25 | C26 | H261 | 108.5° | 108.5° |
| C25 | C26 | H262 | 107.8° | 108.0° |
| C27 | C26 | H261 | 108.5° | 111.5° |
| C27 | C26 | H262 | 107.8° | 109.2° |
| C26 | C27 | C28 | 111.8° | 113.7° |
| C26 | C27 | H271 | 108.7° | 107.7° |
| C26 | C27 | H272 | 108.2° | 108.9° |
| H261 | C26 | H262 | 111.8° | 106.6° |
| C28 | C27 | H271 | 108.7° | 110.2° |
| C28 | C27 | H272 | 108.2° | 109.3° |
| C27 | C28 | C29 | 112.5° | 112.2° |
| C27 | C28 | C33 | 83.6° | 113.5° |
| C27 | C28 | H282 | 123.5° | 106.6° |
| H271 | C27 | H272 | 111.3° | 106.9° |
| C29 | C28 | C33 | 110.7° | 110.4° |
| C29 | C28 | H282 | 101.5° | 105.3° |
| C28 | C29 | O10 | 121.8° | 112.2° |
| C28 | C29 | O11 | 120.8° | 125.2° |
| C33 | C28 | H282 | 124.9° | 108.4° |
| C28 | C33 | C32 | 90.0° | 117.2° |
| C28 | C33 | C34 | 90.0° | 108.5° |
| C28 | C33 | H33 | 90.0° | 109.8° |
| O10 | C29 | O11 | 117.5° | 122.6° |
| C29 | O10 | HO10 | 109.5° | 115.3° |
| C20 | C19 | C18 | 101.8° | 110.3° |
| C20 | C19 | H19 | 125.9° | 109.2° |
| C18 | C19 | H19 | 101.7° | 112.2° |
| C19 | C18 | C17 | 122.5° | 113.4° |
| C19 | C18 | H181 | 105.3° | 109.3° |
| C19 | C18 | H182 | 102.3° | 109.8° |
| C17 | C16 | N2 | 119.0° | 111.6° |
| C16 | C17 | C18 | 107.6° | 113.6° |
| C16 | C17 | H171 | 110.1° | 109.4° |
| C16 | C17 | H172 | 110.6° | 106.9° |
| C16 | N2 | C15 | 126.7° | 122.7° |
| C16 | N2 | HN2 | 116.6° | 118.7° |
| C18 | C17 | H171 | 110.1° | 110.7° |
| C18 | C17 | H172 | 110.5° | 108.8° |
| C17 | C18 | H181 | 105.3° | 108.3° |
| C17 | C18 | H182 | 102.3° | 109.6° |
| H171 | C17 | H172 | 108.0° | 107.3° |
| H181 | C18 | H182 | 120.4° | 106.1° |
| C15 | N2 | HN2 | 116.7° | 118.7° |
| N2 | C15 | C12 | 114.3° | 112.6° |
| N2 | C15 | H151 | 107.9° | 106.8° |
| N2 | C15 | H152 | 106.8° | 107.6° |
| C12 | C15 | H151 | 107.9° | 109.9° |
| C12 | C15 | H152 | 106.8° | 111.7° |
| C15 | C12 | H121 | 106.1° | 109.3° |
| C15 | C12 | H122 | 103.6° | 110.2° |
| H151 | C15 | H152 | 113.3° | 108.2° |
| H121 | C12 | H122 | 118.1° | 105.9° |
| C10 | C11 | H11 | 119.2° | 119.5° |
| C11 | C10 | C9 | 120.6° | 120.0° |
| C11 | C10 | H10 | 119.7° | 119.6° |
| C9 | C10 | H10 | 119.7° | 120.4° |
| C10 | C9 | C8 | 118.0° | 120.0° |
| C8 | C7 | H7 | 120.1° | 119.5° |
| C7 | C8 | C9 | 121.8° | 120.0° |
| C7 | C8 | H8 | 119.1° | 119.7° |
| C9 | C8 | H8 | 119.1° | 120.4° |
| H131 | C13 | H132 | 109.0° | 107.9° |
| C35 | N1 | HN11 | 125.8° | 118.4° |
| N1 | C35 | O16 | 90.0° | 128.1° |
| N1 | C35 | H35 | 90.0° | 110.4° |
| C30 | O12 | H12 | 90.0° | 115.0° |
| O12 | C30 | O13 | 90.0° | 123.1° |
| O12 | C30 | C31 | 90.0° | 111.4° |
| O13 | C30 | C31 | 90.0° | 125.5° |
| C30 | C31 | C32 | 90.0° | 111.8° |
| C30 | C31 | H311 | 90.0° | 108.1° |
| C30 | C31 | H312 | 90.0° | 107.3° |
| C32 | C31 | H311 | 90.0° | 109.6° |
| C32 | C31 | H312 | 90.0° | 110.4° |
| C31 | C32 | C33 | 90.0° | 113.9° |
| C31 | C32 | H321 | 90.0° | 108.4° |
| C31 | C32 | H322 | 90.0° | 109.9° |
| H311 | C31 | H312 | 90.0° | 109.4° |
| C33 | C32 | H321 | 90.0° | 108.2° |
| C33 | C32 | H322 | 90.0° | 111.1° |
| C32 | C33 | C34 | 90.0° | 109.2° |
| C32 | C33 | H33 | 90.0° | 105.7° |
| H321 | C32 | H322 | 90.0° | 105.0° |
| C34 | C33 | H33 | 90.0° | 106.0° |
| C33 | C34 | O14 | 90.0° | 124.8° |
| C33 | C34 | O15 | 90.0° | 112.4° |
| O14 | C34 | O15 | 90.0° | 122.8° |
| C34 | O15 | H15 | 90.0° | 115.4° |
| O16 | C35 | H35 | 90.0° | 121.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | N1 | H11A | 120.0° | 123.6° |
| C2 | C1 | N1 | H12A | 120.2° | 124.1° |
| C2 | C1 | H11A | H12A | 120.3° | 123.0° |
| C1 | C2 | O1 | C3 | 179.9° | 180.0° |
| C1 | C2 | O1 | C5 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 180.0° | 180.0° |
| C1 | C2 | C3 | H3 | 0.0° | 0.0° |
| C2 | C1 | N1 | C35 | 136.8° | 93.7° |
| C2 | C1 | N1 | HN11 | 43.2° | 86.4° |
| N1 | C1 | H11A | H12A | 120.2° | 112.8° |
| N1 | C1 | C2 | O1 | 98.0° | 90.0° |
| N1 | C1 | C2 | C3 | 81.9° | 90.0° |
| C1 | N1 | C35 | HN11 | 180.0° | 179.9° |
| C1 | N1 | C35 | O16 | 90.0° | 0.1° |
| C1 | N1 | C35 | H35 | 90.0° | 180.0° |
| H11A | C1 | C2 | O1 | 22.0° | 30.4° |
| H11A | C1 | C2 | C3 | 158.1° | 149.6° |
| H11A | C1 | N1 | C35 | 103.2° | 30.0° |
| H11A | C1 | N1 | HN11 | 76.9° | 150.0° |
| H12A | C1 | C2 | O1 | 141.7° | 149.5° |
| H12A | C1 | C2 | C3 | 38.4° | 30.5° |
| H12A | C1 | N1 | C35 | 16.6° | 142.3° |
| H12A | C1 | N1 | HN11 | 163.4° | 37.7° |
| O1 | C2 | C3 | C4 | 0.1° | 0.0° |
| O1 | C2 | C3 | H3 | 179.9° | 180.0° |
| C2 | O1 | C5 | C4 | 0.0° | 0.0° |
| C2 | O1 | C5 | H5 | 180.0° | 179.9° |
| C5 | O1 | C2 | C3 | 0.1° | 0.0° |
| O1 | C5 | C4 | C3 | 0.0° | 0.0° |
| O1 | C5 | C4 | H5 | 180.0° | 179.9° |
| O1 | C5 | C4 | C13 | 179.5° | 180.0° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.1° | 0.0° |
| C2 | C3 | C4 | C13 | 179.5° | 180.0° |
| C9 | O2 | C13 | C4 | 161.3° | 178.6° |
| O2 | C9 | C10 | C11 | 178.6° | 179.9° |
| O2 | C9 | C10 | C8 | 176.6° | 179.9° |
| O2 | C9 | C10 | H10 | 1.4° | 0.1° |
| O2 | C9 | C8 | C7 | 178.7° | 179.9° |
| O2 | C9 | C8 | H8 | 1.3° | 0.0° |
| C9 | O2 | C13 | H131 | 78.7° | 60.0° |
| C9 | O2 | C13 | H132 | 41.0° | 57.6° |
| O2 | C13 | C4 | C3 | 135.0° | 90.0° |
| O2 | C13 | C4 | C5 | 44.4° | 89.9° |
| O2 | C13 | C4 | H131 | 120.0° | 120.1° |
| O2 | C13 | C4 | H132 | 120.3° | 120.1° |
| C13 | O2 | C9 | C10 | 114.5° | 180.0° |
| C13 | O2 | C9 | C8 | 69.0° | 0.1° |
| O2 | C13 | H131 | H132 | 120.3° | 118.4° |
| C3 | C4 | C5 | C13 | 179.5° | 180.0° |
| C3 | C4 | C5 | H5 | 180.0° | 179.9° |
| C3 | C4 | C13 | H131 | 105.0° | 30.1° |
| C3 | C4 | C13 | H132 | 14.7° | 149.9° |
| H3 | C3 | C4 | C5 | 179.9° | 180.0° |
| H3 | C3 | C4 | C13 | 0.5° | 0.0° |
| O3 | C16 | C17 | N2 | 155.9° | 178.9° |
| O3 | C16 | C17 | C18 | 128.4° | 1.2° |
| O3 | C16 | C17 | H171 | 8.4° | 125.4° |
| O3 | C16 | C17 | H172 | 110.9° | 118.8° |
| O3 | C16 | N2 | C15 | 73.4° | 0.1° |
| O3 | C16 | N2 | HN2 | 106.6° | 180.0° |
| C5 | C4 | C13 | H131 | 75.6° | 149.9° |
| C5 | C4 | C13 | H132 | 164.7° | 30.1° |
| C13 | C4 | C5 | H5 | 0.5° | 0.1° |
| C4 | C13 | H131 | H132 | 120.3° | 121.4° |
| O4 | C20 | O5 | C19 | 179.6° | 177.7° |
| O4 | C20 | O5 | HO5 | 0.0° | 0.0° |
| O4 | C20 | C19 | N3 | 61.8° | 35.9° |
| O4 | C20 | C19 | C18 | 165.7° | 86.3° |
| O4 | C20 | C19 | H19 | 51.6° | 150.0° |
| O5 | C20 | C19 | N3 | 117.8° | 141.7° |
| O5 | C20 | C19 | C18 | 14.7° | 96.1° |
| O5 | C20 | C19 | H19 | 128.7° | 27.7° |
| HO5 | O5 | C20 | C19 | 179.6° | 177.7° |
| C12 | C6 | C11 | C7 | 179.3° | 180.0° |
| C6 | C12 | C15 | N2 | 116.9° | 61.1° |
| C6 | C12 | C15 | H121 | 120.0° | 120.9° |
| C6 | C12 | C15 | H122 | 114.9° | 123.2° |
| C6 | C12 | C15 | H151 | 3.1° | 180.0° |
| C6 | C12 | C15 | H152 | 125.2° | 59.9° |
| C6 | C12 | H121 | H122 | 115.7° | 117.8° |
| C12 | C6 | C11 | C10 | 179.8° | 180.0° |
| C12 | C6 | C11 | H11 | 0.1° | 0.0° |
| C12 | C6 | C7 | C8 | 179.9° | 180.0° |
| C12 | C6 | C7 | H7 | 0.1° | 0.0° |
| C11 | C6 | C12 | C15 | 149.0° | 90.0° |
| C11 | C6 | C12 | H121 | 29.0° | 148.6° |
| C11 | C6 | C12 | H122 | 96.1° | 33.4° |
| C6 | C11 | C10 | H11 | 180.0° | 180.0° |
| C6 | C11 | C10 | C9 | 1.2° | 0.0° |
| C6 | C11 | C10 | H10 | 178.8° | 179.9° |
| C11 | C6 | C7 | C8 | 0.7° | 0.0° |
| C11 | C6 | C7 | H7 | 179.3° | 180.0° |
| C7 | C6 | C12 | C15 | 31.8° | 90.0° |
| C7 | C6 | C12 | H121 | 151.8° | 31.4° |
| C7 | C6 | C12 | H122 | 83.1° | 146.7° |
| C7 | C6 | C11 | C10 | 0.5° | 0.0° |
| C7 | C6 | C11 | H11 | 179.4° | 180.0° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 1.6° | 0.0° |
| C6 | C7 | C8 | H8 | 178.4° | 179.9° |
| C21 | N3 | C19 | HN3 | 180.0° | 179.9° |
| N3 | C21 | O6 | C22 | 175.7° | 178.6° |
| N3 | C21 | C22 | C14 | 113.5° | 180.0° |
| N3 | C21 | C22 | H221 | 126.5° | 55.8° |
| N3 | C21 | C22 | H222 | 5.5° | 60.1° |
| C21 | N3 | C19 | C20 | 89.8° | 116.2° |
| C21 | N3 | C19 | C18 | 154.4° | 122.9° |
| C21 | N3 | C19 | H19 | 41.1° | 0.0° |
| C19 | N3 | C21 | O6 | 91.2° | 0.0° |
| C19 | N3 | C21 | C22 | 83.5° | 178.8° |
| N3 | C19 | C20 | C18 | 132.5° | 122.2° |
| N3 | C19 | C20 | H19 | 113.5° | 114.0° |
| N3 | C19 | C18 | H19 | 112.7° | 119.3° |
| N3 | C19 | C18 | C17 | 13.8° | 60.3° |
| N3 | C19 | C18 | H181 | 106.2° | 178.7° |
| N3 | C19 | C18 | H182 | 127.2° | 62.7° |
| HN3 | N3 | C21 | O6 | 88.8° | 180.0° |
| HN3 | N3 | C21 | C22 | 96.5° | 1.3° |
| HN3 | N3 | C19 | C20 | 90.1° | 63.7° |
| HN3 | N3 | C19 | C18 | 25.6° | 57.2° |
| HN3 | N3 | C19 | H19 | 138.9° | 180.0° |
| O6 | C21 | C22 | C14 | 61.2° | 1.2° |
| O6 | C21 | C22 | H221 | 58.8° | 125.4° |
| O6 | C21 | C22 | H222 | 179.7° | 118.7° |
| C21 | C22 | C14 | H221 | 120.0° | 123.5° |
| C21 | C22 | C14 | H222 | 119.0° | 118.9° |
| C21 | C22 | H221 | H222 | 119.0° | 115.6° |
| C21 | C22 | C14 | C23 | 173.8° | 178.5° |
| C21 | C22 | C14 | H141 | 53.8° | 60.0° |
| C21 | C22 | C14 | H142 | 68.7° | 55.4° |
| C14 | C22 | H221 | H222 | 119.0° | 118.5° |
| C22 | C14 | C23 | H141 | 120.0° | 121.0° |
| C22 | C14 | C23 | H142 | 117.6° | 122.9° |
| C22 | C14 | H141 | H142 | 117.8° | 117.7° |
| C22 | C14 | C23 | C24 | 111.9° | 179.0° |
| C22 | C14 | C23 | N4 | 128.6° | 62.3° |
| C22 | C14 | C23 | H23 | 9.2° | 57.1° |
| H221 | C22 | C14 | C23 | 66.2° | 54.9° |
| H221 | C22 | C14 | H141 | 173.8° | 176.4° |
| H221 | C22 | C14 | H142 | 51.4° | 68.1° |
| H222 | C22 | C14 | C23 | 54.8° | 62.7° |
| H222 | C22 | C14 | H141 | 65.2° | 58.8° |
| H222 | C22 | C14 | H142 | 172.3° | 174.3° |
| C23 | C14 | H141 | H142 | 117.8° | 118.3° |
| C14 | C23 | C24 | N4 | 123.7° | 122.3° |
| C14 | C23 | C24 | H23 | 116.6° | 123.7° |
| C14 | C23 | N4 | H23 | 116.5° | 122.9° |
| C14 | C23 | C24 | O7 | 42.7° | 91.3° |
| C14 | C23 | C24 | O8 | 137.7° | 86.3° |
| C14 | C23 | N4 | C25 | 38.7° | 152.9° |
| C14 | C23 | N4 | HN4 | 141.3° | 27.1° |
| H141 | C14 | C23 | C24 | 8.1° | 60.0° |
| H141 | C14 | C23 | N4 | 111.4° | 58.7° |
| H141 | C14 | C23 | H23 | 129.2° | 178.1° |
| H142 | C14 | C23 | C24 | 130.6° | 56.0° |
| H142 | C14 | C23 | N4 | 11.1° | 174.8° |
| H142 | C14 | C23 | H23 | 108.4° | 65.9° |
| C24 | C23 | N4 | H23 | 121.2° | 116.2° |
| C23 | C24 | O7 | O8 | 179.7° | 177.7° |
| C23 | C24 | O7 | HO7 | 179.7° | 177.7° |
| C24 | C23 | N4 | C25 | 160.9° | 86.2° |
| C24 | C23 | N4 | HN4 | 19.1° | 93.8° |
| N4 | C23 | C24 | O7 | 166.4° | 146.4° |
| N4 | C23 | C24 | O8 | 13.9° | 36.0° |
| C23 | N4 | C25 | HN4 | 180.0° | 180.0° |
| C23 | N4 | C25 | O9 | 73.2° | 0.0° |
| C23 | N4 | C25 | C26 | 131.7° | 179.8° |
| H23 | C23 | C24 | O7 | 73.9° | 32.4° |
| H23 | C23 | C24 | O8 | 105.7° | 150.0° |
| H23 | C23 | N4 | C25 | 77.9° | 30.0° |
| H23 | C23 | N4 | HN4 | 102.2° | 150.0° |
| O8 | C24 | O7 | HO7 | 0.0° | 0.0° |
| N4 | C25 | O9 | C26 | 155.2° | 179.8° |
| N4 | C25 | C26 | C27 | 52.4° | 180.0° |
| N4 | C25 | C26 | H261 | 172.4° | 56.0° |
| N4 | C25 | C26 | H262 | 66.3° | 59.2° |
| HN4 | N4 | C25 | O9 | 106.8° | 180.0° |
| HN4 | N4 | C25 | C26 | 48.3° | 0.2° |
| O9 | C25 | C26 | C27 | 152.3° | 0.2° |
| O9 | C25 | C26 | H261 | 32.3° | 124.1° |
| O9 | C25 | C26 | H262 | 89.0° | 120.6° |
| C25 | C26 | C27 | H261 | 120.0° | 122.4° |
| C25 | C26 | C27 | H262 | 118.7° | 120.1° |
| C25 | C26 | H261 | H262 | 118.8° | 116.1° |
| C25 | C26 | C27 | C28 | 94.6° | 177.6° |
| C25 | C26 | C27 | H271 | 145.4° | 60.0° |
| C25 | C26 | C27 | H272 | 24.4° | 55.5° |
| C27 | C26 | H261 | H262 | 118.8° | 119.1° |
| C26 | C27 | C28 | H271 | 120.0° | 121.0° |
| C26 | C27 | C28 | H272 | 119.0° | 121.9° |
| C26 | C27 | H271 | H272 | 119.0° | 116.8° |
| C26 | C27 | C28 | C29 | 39.6° | 59.0° |
| C26 | C27 | C28 | C33 | 149.5° | 175.0° |
| C26 | C27 | C28 | H282 | 82.5° | 55.8° |
| H261 | C26 | C27 | C28 | 25.4° | 55.3° |
| H261 | C26 | C27 | H271 | 94.6° | 177.7° |
| H261 | C26 | C27 | H272 | 144.4° | 66.8° |
| H262 | C26 | C27 | C28 | 146.7° | 62.3° |
| H262 | C26 | C27 | H271 | 26.7° | 60.1° |
| H262 | C26 | C27 | H272 | 94.3° | 175.6° |
| C28 | C27 | H271 | H272 | 119.0° | 118.6° |
| C27 | C28 | C29 | C33 | 91.6° | 127.7° |
| C27 | C28 | C29 | H282 | 133.9° | 115.5° |
| C27 | C28 | C33 | H282 | 126.8° | 118.2° |
| C27 | C28 | C29 | O10 | 58.9° | 115.9° |
| C27 | C28 | C29 | O11 | 121.6° | 64.4° |
| C27 | C28 | C33 | C32 | 90.0° | 67.4° |
| C27 | C28 | C33 | C34 | 90.0° | 168.5° |
| C27 | C28 | C33 | H33 | 90.0° | 53.1° |
| H271 | C27 | C28 | C29 | 80.4° | 180.0° |
| H271 | C27 | C28 | C33 | 29.5° | 54.0° |
| H271 | C27 | C28 | H282 | 157.5° | 65.3° |
| H272 | C27 | C28 | C29 | 158.6° | 62.9° |
| H272 | C27 | C28 | C33 | 91.5° | 63.1° |
| H272 | C27 | C28 | H282 | 36.5° | 177.6° |
| C29 | C28 | C33 | H282 | 121.6° | 114.8° |
| C28 | C29 | O10 | O11 | 179.5° | 179.7° |
| C28 | C29 | O10 | HO10 | 179.5° | 179.7° |
| C29 | C28 | C33 | C32 | 90.0° | 59.5° |
| C29 | C28 | C33 | C34 | 90.0° | 64.6° |
| C29 | C28 | C33 | H33 | 90.0° | 180.0° |
| C33 | C28 | C29 | O10 | 150.6° | 116.4° |
| C33 | C28 | C29 | O11 | 30.0° | 63.3° |
| C28 | C33 | C32 | C31 | 90.0° | 55.6° |
| C28 | C33 | C32 | C34 | 90.0° | 123.8° |
| C28 | C33 | C32 | H33 | 90.0° | 122.7° |
| C28 | C33 | C32 | H321 | 90.0° | 176.2° |
| C28 | C33 | C32 | H322 | 90.0° | 69.1° |
| C28 | C33 | C34 | H33 | 90.0° | 117.9° |
| C28 | C33 | C34 | O14 | 90.0° | 92.1° |
| C28 | C33 | C34 | O15 | 90.0° | 86.9° |
| H282 | C28 | C29 | O10 | 74.9° | 0.4° |
| H282 | C28 | C29 | O11 | 104.6° | 179.9° |
| H282 | C28 | C33 | C32 | 90.0° | 174.3° |
| H282 | C28 | C33 | C34 | 90.0° | 50.2° |
| H282 | C28 | C33 | H33 | 90.0° | 65.1° |
| O11 | C29 | O10 | HO10 | 0.0° | 0.0° |
| C20 | C19 | C18 | H19 | 131.0° | 122.0° |
| C20 | C19 | C18 | C17 | 102.5° | 179.0° |
| C20 | C19 | C18 | H181 | 137.5° | 60.0° |
| C20 | C19 | C18 | H182 | 10.9° | 56.0° |
| C19 | C18 | C17 | C16 | 162.6° | 178.5° |
| C19 | C18 | C17 | H181 | 120.0° | 121.5° |
| C19 | C18 | C17 | H182 | 113.4° | 123.1° |
| C19 | C18 | C17 | H171 | 77.4° | 55.0° |
| C19 | C18 | C17 | H172 | 41.9° | 62.7° |
| C19 | C18 | H181 | H182 | 114.6° | 118.3° |
| H19 | C19 | C18 | C17 | 126.5° | 59.0° |
| H19 | C19 | C18 | H181 | 6.5° | 62.0° |
| H19 | C19 | C18 | H182 | 120.1° | 178.0° |
| C16 | C17 | C18 | H171 | 120.0° | 123.5° |
| C16 | C17 | C18 | H172 | 120.8° | 118.9° |
| C16 | C17 | H171 | H172 | 120.8° | 115.6° |
| C16 | C17 | C18 | H181 | 77.4° | 60.0° |
| C16 | C17 | C18 | H182 | 49.2° | 55.4° |
| C17 | C16 | N2 | C15 | 131.2° | 178.8° |
| C17 | C16 | N2 | HN2 | 48.9° | 1.2° |
| N2 | C16 | C17 | C18 | 75.7° | 179.9° |
| N2 | C16 | C17 | H171 | 164.3° | 55.7° |
| N2 | C16 | C17 | H172 | 45.0° | 60.1° |
| C16 | N2 | C15 | HN2 | 180.0° | 179.9° |
| C16 | N2 | C15 | C12 | 64.9° | 90.0° |
| C16 | N2 | C15 | H151 | 175.1° | 30.7° |
| C16 | N2 | C15 | H152 | 53.0° | 146.6° |
| C18 | C17 | H171 | H172 | 120.8° | 118.6° |
| C17 | C18 | H181 | H182 | 114.6° | 117.7° |
| H171 | C17 | C18 | H181 | 42.6° | 176.5° |
| H171 | C17 | C18 | H182 | 169.2° | 68.1° |
| H172 | C17 | C18 | H181 | 161.9° | 58.9° |
| H172 | C17 | C18 | H182 | 71.5° | 174.3° |
| N2 | C15 | C12 | H151 | 120.0° | 118.9° |
| N2 | C15 | C12 | H152 | 117.9° | 121.1° |
| N2 | C15 | H151 | H152 | 118.0° | 115.5° |
| N2 | C15 | C12 | H121 | 3.1° | 178.0° |
| N2 | C15 | C12 | H122 | 128.2° | 62.0° |
| HN2 | N2 | C15 | C12 | 115.1° | 90.0° |
| HN2 | N2 | C15 | H151 | 4.9° | 149.3° |
| HN2 | N2 | C15 | H152 | 127.0° | 33.4° |
| C12 | C15 | H151 | H152 | 118.0° | 122.1° |
| C15 | C12 | H121 | H122 | 115.7° | 118.6° |
| H151 | C15 | C12 | H121 | 123.1° | 59.1° |
| H151 | C15 | C12 | H122 | 111.8° | 56.9° |
| H152 | C15 | C12 | H121 | 114.8° | 61.0° |
| H152 | C15 | C12 | H122 | 10.4° | 176.9° |
| C11 | C10 | C9 | H10 | 180.0° | 180.0° |
| C11 | C10 | C9 | C8 | 2.0° | 0.0° |
| H11 | C11 | C10 | C9 | 178.8° | 180.0° |
| H11 | C11 | C10 | H10 | 1.2° | 0.0° |
| C10 | C9 | C8 | C7 | 2.2° | 0.0° |
| C10 | C9 | C8 | H8 | 177.8° | 179.9° |
| H10 | C10 | C9 | C8 | 178.0° | 180.0° |
| C7 | C8 | C9 | H8 | 180.0° | 179.9° |
| H7 | C7 | C8 | C9 | 178.4° | 180.0° |
| H7 | C7 | C8 | H8 | 1.6° | 0.1° |
| N1 | C35 | O16 | H35 | 90.0° | 180.0° |
| HN11 | N1 | C35 | O16 | 90.0° | 180.0° |
| HN11 | N1 | C35 | H35 | 90.0° | 0.0° |
| O12 | C30 | O13 | C31 | 90.0° | 179.5° |
| O12 | C30 | C31 | C32 | 90.0° | 178.7° |
| O12 | C30 | C31 | H311 | 90.0° | 60.5° |
| O12 | C30 | C31 | H312 | 90.0° | 57.5° |
| H12 | O12 | C30 | O13 | 90.0° | 0.0° |
| H12 | O12 | C30 | C31 | 90.0° | 179.6° |
| O13 | C30 | C31 | C32 | 90.0° | 0.8° |
| O13 | C30 | C31 | H311 | 90.0° | 120.0° |
| O13 | C30 | C31 | H312 | 90.0° | 122.1° |
| C30 | C31 | C32 | H311 | 90.0° | 119.9° |
| C30 | C31 | C32 | H312 | 90.0° | 119.4° |
| C30 | C31 | H311 | H312 | 90.0° | 116.6° |
| C30 | C31 | C32 | C33 | 90.0° | 179.4° |
| C30 | C31 | C32 | H321 | 90.0° | 60.1° |
| C30 | C31 | C32 | H322 | 90.0° | 54.1° |
| C32 | C31 | H311 | H312 | 90.0° | 121.3° |
| C31 | C32 | C33 | H321 | 90.0° | 120.6° |
| C31 | C32 | C33 | H322 | 90.0° | 124.7° |
| C31 | C32 | H321 | H322 | 90.0° | 117.3° |
| C31 | C32 | C33 | C34 | 90.0° | 179.3° |
| C31 | C32 | C33 | H33 | 90.0° | 67.1° |
| H311 | C31 | C32 | C33 | 90.0° | 60.7° |
| H311 | C31 | C32 | H321 | 90.0° | 59.8° |
| H311 | C31 | C32 | H322 | 90.0° | 174.0° |
| H312 | C31 | C32 | C33 | 90.0° | 60.0° |
| H312 | C31 | C32 | H321 | 90.0° | 179.5° |
| H312 | C31 | C32 | H322 | 90.0° | 65.3° |
| C33 | C32 | H321 | H322 | 90.0° | 118.7° |
| C32 | C33 | C34 | H33 | 90.0° | 113.4° |
| C32 | C33 | C34 | O14 | 90.0° | 36.6° |
| C32 | C33 | C34 | O15 | 90.0° | 144.4° |
| H321 | C32 | C33 | C34 | 90.0° | 60.1° |
| H321 | C32 | C33 | H33 | 90.0° | 53.5° |
| H322 | C32 | C33 | C34 | 90.0° | 54.7° |
| H322 | C32 | C33 | H33 | 90.0° | 168.2° |
| C33 | C34 | O14 | O15 | 90.0° | 179.0° |
| C33 | C34 | O15 | H15 | 90.0° | 179.0° |
| H33 | C33 | C34 | O14 | 90.0° | 150.0° |
| H33 | C33 | C34 | O15 | 90.0° | 31.0° |
| O14 | C34 | O15 | H15 | 90.0° | 0.1° |
