CP0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C13 | sing | 1.35Å | 1.44Å | Aromatic |
| N1 | C2 | doub | 1.34Å | 1.33Å | Aromatic |
| N4 | C3 | sing | 1.39Å | 1.45Å | Aromatic |
| N4 | C23 | sing | 1.38Å | 1.51Å | Aromatic |
| N4 | C5 | sing | 1.48Å | 1.49Å | |
| O1 | C37 | doub | 1.23Å | 1.17Å | |
| O2 | C10 | sing | 1.40Å | 1.43Å | |
| O2 | C37 | sing | 1.40Å | 1.46Å | |
| O18 | C23 | doub | 1.23Å | 1.26Å | |
| O19 | C17 | sing | 1.44Å | 1.48Å | |
| O19 | C21 | sing | 1.35Å | 1.38Å | |
| O22 | C21 | doub | 1.23Å | 1.23Å | |
| O23 | C20 | sing | 1.43Å | 1.45Å | |
| O23 | H23 | sing | 0.97Å | 0.95Å | |
| C13 | C8 | doub | 1.42Å | 1.53Å | Aromatic |
| C13 | C12 | sing | 1.39Å | 1.51Å | Aromatic |
| C10 | C9 | doub | 1.39Å | 1.41Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.54Å | Aromatic |
| C14 | C3 | doub | 1.34Å | 1.37Å | Aromatic |
| C14 | C15 | sing | 1.45Å | 1.48Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.10Å | |
| C6 | C7 | doub | 1.37Å | 1.47Å | Aromatic |
| C6 | C2 | sing | 1.39Å | 1.45Å | Aromatic |
| C6 | C5 | sing | 1.49Å | 1.52Å | |
| C8 | C7 | sing | 1.40Å | 1.49Å | Aromatic |
| C8 | C9 | sing | 1.40Å | 1.49Å | Aromatic |
| C7 | C31 | sing | 1.49Å | 1.56Å | |
| C37 | N2 | sing | 1.40Å | 1.37Å | |
| C3 | C2 | sing | 1.46Å | 1.40Å | Aromatic |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C12 | C11 | doub | 1.40Å | 1.40Å | Aromatic |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | C15 | doub | 1.34Å | 1.42Å | Aromatic |
| C16 | C23 | sing | 1.51Å | 1.52Å | Aromatic |
| C16 | C17 | sing | 1.49Å | 1.56Å | |
| C15 | C20 | sing | 1.50Å | 1.59Å | |
| C17 | H171 | sing | 1.10Å | 1.12Å | |
| C17 | H172 | sing | 1.09Å | 1.11Å | |
| C5 | H51 | sing | 1.09Å | 1.12Å | |
| C5 | H52 | sing | 1.09Å | 1.11Å | |
| C21 | C20 | sing | 1.52Å | 1.60Å | |
| C28 | C20 | sing | 1.53Å | 1.54Å | |
| C28 | C33 | sing | 1.51Å | 1.45Å | |
| C28 | H281 | sing | 1.09Å | 1.12Å | |
| C28 | H282 | sing | 1.08Å | 1.11Å | |
| C31 | C32 | sing | 1.53Å | 1.59Å | |
| C31 | H311 | sing | 1.10Å | 1.11Å | |
| C31 | H312 | sing | 1.10Å | 1.12Å | |
| C32 | H321 | sing | 1.10Å | 1.11Å | |
| C32 | H322 | sing | 1.09Å | 1.11Å | |
| C32 | H323 | sing | 1.09Å | 1.11Å | |
| C33 | H331 | sing | 1.09Å | 1.12Å | |
| C33 | H332 | sing | 1.09Å | 1.11Å | |
| C33 | H333 | sing | 1.09Å | 1.11Å | |
| N2 | C22 | sing | 1.46Å | 1.51Å | |
| N2 | C26 | sing | 1.47Å | 1.45Å | |
| N3 | C24 | sing | 1.46Å | 1.55Å | |
| N3 | C29 | sing | 1.47Å | 1.59Å | |
| N3 | C35 | sing | 1.47Å | 1.50Å | |
| C25 | C24 | sing | 1.53Å | 1.52Å | |
| C25 | C26 | sing | 1.53Å | 1.55Å | |
| C25 | H251 | sing | 1.10Å | 1.12Å | |
| C25 | H252 | sing | 1.10Å | 1.12Å | |
| C22 | C36 | sing | 1.53Å | 119.37Å | |
| C22 | H221 | sing | 1.10Å | 1.11Å | |
| C22 | H222 | sing | 1.09Å | 1.11Å | |
| C24 | C36 | sing | 1.53Å | 117.19Å | |
| C24 | H24 | sing | 1.10Å | 1.11Å | |
| C26 | H261 | sing | 1.09Å | 1.12Å | |
| C26 | H262 | sing | 1.10Å | 1.11Å | |
| C29 | C34 | sing | 1.53Å | 1.50Å | |
| C29 | H291 | sing | 1.10Å | 1.11Å | |
| C29 | H292 | sing | 1.10Å | 1.11Å | |
| C34 | C30 | sing | 1.52Å | 1.56Å | |
| C34 | H341 | sing | 1.10Å | 1.12Å | |
| C34 | H342 | sing | 1.10Å | 1.12Å | |
| C35 | C27 | sing | 1.53Å | 1.55Å | |
| C35 | H351 | sing | 1.10Å | 1.11Å | |
| C35 | H352 | sing | 1.10Å | 1.11Å | |
| C27 | C30 | sing | 1.52Å | 1.61Å | |
| C27 | H271 | sing | 1.10Å | 1.12Å | |
| C27 | H272 | sing | 1.10Å | 1.11Å | |
| C30 | H301 | sing | 1.10Å | 1.11Å | |
| C30 | H302 | sing | 1.10Å | 1.12Å | |
| C36 | H11A | sing | 1.10Å | 1.11Å | |
| C36 | H12A | sing | 1.10Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | N1 | C2 | 115.9° | 116.0° |
| N1 | C13 | C8 | 122.8° | 122.5° |
| N1 | C13 | C12 | 113.1° | 119.6° |
| N1 | C2 | C6 | 129.6° | 125.9° |
| N1 | C2 | C3 | 121.8° | 126.4° |
| C3 | N4 | C23 | 123.6° | 123.7° |
| C3 | N4 | C5 | 111.7° | 111.0° |
| N4 | C3 | C14 | 120.8° | 121.6° |
| N4 | C3 | C2 | 108.4° | 108.3° |
| C23 | N4 | C5 | 124.7° | 125.3° |
| N4 | C23 | O18 | 119.4° | 124.5° |
| N4 | C23 | C16 | 112.9° | 114.5° |
| N4 | C5 | C6 | 100.6° | 102.2° |
| N4 | C5 | H51 | 115.6° | 108.7° |
| N4 | C5 | H52 | 115.6° | 108.7° |
| O1 | C37 | O2 | 119.4° | 123.4° |
| O1 | C37 | N2 | 125.2° | 124.2° |
| C10 | O2 | C37 | 126.1° | 114.1° |
| O2 | C10 | C9 | 122.9° | 120.2° |
| O2 | C10 | C11 | 117.8° | 120.1° |
| O2 | C37 | N2 | 115.5° | 112.4° |
| O18 | C23 | C16 | 127.7° | 121.0° |
| C17 | O19 | C21 | 129.6° | 123.8° |
| O19 | C17 | C16 | 114.2° | 114.0° |
| O19 | C17 | H171 | 110.5° | 108.0° |
| O19 | C17 | H172 | 110.5° | 105.6° |
| O19 | C21 | O22 | 118.9° | 120.6° |
| O19 | C21 | C20 | 117.2° | 117.2° |
| O22 | C21 | C20 | 123.8° | 122.1° |
| C20 | O23 | H23 | 109.8° | 106.3° |
| O23 | C20 | C15 | 109.7° | 109.7° |
| O23 | C20 | C21 | 104.6° | 104.5° |
| O23 | C20 | C28 | 100.7° | 109.0° |
| C8 | C13 | C12 | 124.1° | 118.0° |
| C13 | C8 | C7 | 115.9° | 119.0° |
| C13 | C8 | C9 | 116.6° | 120.1° |
| C13 | C12 | C11 | 113.7° | 121.6° |
| C13 | C12 | H12 | 126.5° | 119.8° |
| C9 | C10 | C11 | 119.4° | 119.7° |
| C10 | C9 | C8 | 120.8° | 120.5° |
| C10 | C9 | H9 | 117.0° | 118.3° |
| C10 | C11 | C12 | 125.6° | 120.1° |
| C10 | C11 | H11 | 122.4° | 120.3° |
| C3 | C14 | C15 | 119.9° | 118.9° |
| C3 | C14 | H14 | 116.2° | 121.4° |
| C14 | C3 | C2 | 130.8° | 130.1° |
| C15 | C14 | H14 | 124.0° | 119.7° |
| C14 | C15 | C16 | 121.4° | 120.6° |
| C14 | C15 | C20 | 117.8° | 119.4° |
| C7 | C6 | C2 | 116.2° | 118.4° |
| C7 | C6 | C5 | 133.1° | 130.8° |
| C6 | C7 | C8 | 119.5° | 118.2° |
| C6 | C7 | C31 | 122.0° | 119.0° |
| C2 | C6 | C5 | 110.7° | 110.8° |
| C6 | C2 | C3 | 108.6° | 107.7° |
| C6 | C5 | H51 | 115.6° | 112.9° |
| C6 | C5 | H52 | 115.6° | 112.9° |
| C7 | C8 | C9 | 127.5° | 120.9° |
| C8 | C7 | C31 | 118.5° | 122.8° |
| C8 | C9 | H9 | 122.3° | 121.2° |
| C7 | C31 | C32 | 118.0° | 112.3° |
| C7 | C31 | H311 | 109.1° | 110.3° |
| C7 | C31 | H312 | 109.1° | 110.3° |
| C37 | N2 | C22 | 144.3° | 120.5° |
| C37 | N2 | C26 | 103.4° | 124.1° |
| C11 | C12 | H12 | 119.8° | 118.5° |
| C12 | C11 | H11 | 112.1° | 119.5° |
| C15 | C16 | C23 | 121.4° | 120.6° |
| C15 | C16 | C17 | 122.4° | 121.1° |
| C16 | C15 | C20 | 120.8° | 120.0° |
| C23 | C16 | C17 | 116.2° | 118.2° |
| C16 | C17 | H171 | 110.5° | 110.8° |
| C16 | C17 | H172 | 110.5° | 110.3° |
| C15 | C20 | C21 | 115.8° | 112.5° |
| C15 | C20 | C28 | 109.4° | 111.6° |
| H171 | C17 | H172 | 99.8° | 107.9° |
| H51 | C5 | H52 | 94.9° | 110.9° |
| C21 | C20 | C28 | 115.4° | 109.3° |
| C20 | C28 | C33 | 116.8° | 110.8° |
| C20 | C28 | H281 | 109.5° | 107.6° |
| C20 | C28 | H282 | 109.5° | 107.6° |
| C33 | C28 | H281 | 109.6° | 111.0° |
| C33 | C28 | H282 | 109.6° | 110.9° |
| C28 | C33 | H331 | 116.8° | 111.5° |
| C28 | C33 | H332 | 109.5° | 111.6° |
| C28 | C33 | H333 | 109.5° | 109.3° |
| H281 | C28 | H282 | 100.6° | 108.9° |
| C32 | C31 | H311 | 109.2° | 109.2° |
| C32 | C31 | H312 | 109.2° | 109.2° |
| C31 | C32 | H321 | 118.0° | 111.0° |
| C31 | C32 | H322 | 109.1° | 110.6° |
| C31 | C32 | H323 | 109.1° | 111.1° |
| H311 | C31 | H312 | 101.0° | 105.4° |
| H321 | C32 | H322 | 109.1° | 108.0° |
| H321 | C32 | H323 | 109.2° | 107.9° |
| H322 | C32 | H323 | 101.0° | 108.1° |
| H331 | C33 | H332 | 109.6° | 107.8° |
| H331 | C33 | H333 | 109.6° | 108.3° |
| H332 | C33 | H333 | 100.6° | 108.3° |
| C22 | N2 | C26 | 112.2° | 115.4° |
| N2 | C22 | C36 | 80.5° | 110.9° |
| N2 | C22 | H221 | 124.3° | 107.3° |
| N2 | C22 | H222 | 124.3° | 110.7° |
| N2 | C26 | C25 | 104.3° | 110.8° |
| N2 | C26 | H261 | 114.1° | 111.5° |
| N2 | C26 | H262 | 114.2° | 107.2° |
| C24 | N3 | C29 | 112.7° | 110.5° |
| C24 | N3 | C35 | 111.9° | 110.5° |
| N3 | C24 | C25 | 110.6° | 110.1° |
| N3 | C24 | C36 | 18.4° | 110.1° |
| N3 | C24 | H24 | 142.2° | 108.1° |
| C29 | N3 | C35 | 107.4° | 111.2° |
| N3 | C29 | C34 | 106.7° | 111.2° |
| N3 | C29 | H291 | 113.3° | 110.7° |
| N3 | C29 | H292 | 113.3° | 109.6° |
| N3 | C35 | C27 | 114.6° | 111.2° |
| N3 | C35 | H351 | 110.3° | 109.5° |
| N3 | C35 | H352 | 110.3° | 110.7° |
| C24 | C25 | C26 | 111.4° | 111.0° |
| C24 | C25 | H251 | 111.5° | 110.3° |
| C24 | C25 | H252 | 111.5° | 109.8° |
| C25 | C24 | C36 | 93.1° | 110.5° |
| C25 | C24 | H24 | 107.1° | 109.1° |
| C26 | C25 | H251 | 111.5° | 109.5° |
| C26 | C25 | H252 | 111.5° | 109.0° |
| C25 | C26 | H261 | 114.1° | 109.5° |
| C25 | C26 | H262 | 114.1° | 110.4° |
| H251 | C25 | H252 | 98.8° | 107.1° |
| C36 | C22 | H221 | 124.3° | 110.5° |
| C36 | C22 | H222 | 124.3° | 109.8° |
| C22 | C36 | C24 | 0.7° | 111.0° |
| C22 | C36 | H11A | 179.4° | 109.0° |
| C22 | C36 | H12A | 179.4° | 109.5° |
| H221 | C22 | H222 | 84.9° | 107.5° |
| C36 | C24 | H24 | 159.6° | 109.0° |
| C24 | C36 | H11A | 179.4° | 109.8° |
| C24 | C36 | H12A | 179.4° | 110.3° |
| H261 | C26 | H262 | 96.4° | 107.4° |
| C34 | C29 | H291 | 113.2° | 109.7° |
| C34 | C29 | H292 | 113.2° | 108.4° |
| C29 | C34 | C30 | 110.0° | 111.3° |
| C29 | C34 | H341 | 112.1° | 109.7° |
| C29 | C34 | H342 | 112.1° | 109.5° |
| H291 | C29 | H292 | 97.3° | 107.2° |
| C30 | C34 | H341 | 112.0° | 109.7° |
| C30 | C34 | H342 | 112.0° | 109.5° |
| C34 | C30 | C27 | 115.3° | 110.4° |
| C34 | C30 | H301 | 110.1° | 110.1° |
| C34 | C30 | H302 | 110.1° | 109.5° |
| H341 | C34 | H342 | 98.3° | 106.9° |
| C27 | C35 | H351 | 110.3° | 108.4° |
| C27 | C35 | H352 | 110.3° | 109.7° |
| C35 | C27 | C30 | 114.0° | 111.3° |
| C35 | C27 | H271 | 110.6° | 109.6° |
| C35 | C27 | H272 | 110.6° | 109.7° |
| H351 | C35 | H352 | 100.0° | 107.3° |
| C30 | C27 | H271 | 110.5° | 109.5° |
| C30 | C27 | H272 | 110.5° | 109.7° |
| C27 | C30 | H301 | 110.1° | 110.1° |
| C27 | C30 | H302 | 110.1° | 109.5° |
| H271 | C27 | H272 | 99.7° | 107.0° |
| H301 | C30 | H302 | 100.2° | 107.2° |
| H11A | C36 | H12A | 1.0° | 107.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C13 | C8 | C12 | 179.5° | 180.0° |
| C13 | N1 | C2 | C6 | 0.1° | 0.0° |
| N1 | C13 | C8 | C7 | 0.3° | 0.0° |
| N1 | C13 | C8 | C9 | 179.4° | 180.0° |
| C13 | N1 | C2 | C3 | 179.2° | 179.9° |
| N1 | C13 | C12 | C11 | 179.4° | 180.0° |
| N1 | C13 | C12 | H12 | 0.6° | 0.1° |
| N1 | C2 | C3 | N4 | 179.9° | 180.0° |
| C2 | N1 | C13 | C8 | 0.2° | 0.0° |
| C2 | N1 | C13 | C12 | 179.7° | 180.0° |
| N1 | C2 | C3 | C14 | 0.3° | 0.3° |
| N1 | C2 | C6 | C7 | 0.4° | 0.0° |
| N1 | C2 | C6 | C3 | 179.4° | 179.9° |
| N1 | C2 | C6 | C5 | 179.9° | 179.9° |
| C3 | N4 | C23 | C5 | 179.3° | 179.3° |
| C3 | N4 | C23 | O18 | 179.8° | 179.2° |
| N4 | C3 | C14 | C2 | 179.7° | 179.6° |
| N4 | C3 | C14 | C15 | 0.4° | 0.4° |
| N4 | C3 | C14 | H14 | 179.5° | 179.1° |
| N4 | C3 | C2 | C6 | 0.6° | 0.1° |
| C3 | N4 | C5 | C6 | 0.2° | 0.1° |
| C3 | N4 | C23 | C16 | 0.0° | 0.6° |
| C3 | N4 | C5 | H51 | 125.4° | 119.7° |
| C3 | N4 | C5 | H52 | 125.1° | 119.5° |
| N4 | C23 | O18 | C16 | 179.8° | 179.8° |
| C23 | N4 | C3 | C14 | 0.4° | 0.4° |
| C23 | N4 | C5 | C6 | 179.6° | 179.2° |
| C23 | N4 | C3 | C2 | 179.9° | 179.2° |
| N4 | C23 | C16 | C15 | 0.2° | 0.1° |
| N4 | C23 | C16 | C17 | 179.8° | 179.1° |
| C23 | N4 | C5 | H51 | 55.2° | 59.6° |
| C23 | N4 | C5 | H52 | 54.3° | 61.1° |
| C5 | N4 | C23 | O18 | 0.5° | 0.1° |
| C5 | N4 | C3 | C14 | 179.8° | 179.8° |
| N4 | C5 | C6 | C7 | 179.2° | 180.0° |
| N4 | C5 | C6 | C2 | 0.2° | 0.1° |
| N4 | C5 | C6 | H51 | 125.2° | 116.6° |
| N4 | C5 | C6 | H52 | 125.2° | 116.6° |
| C5 | N4 | C3 | C2 | 0.5° | 0.1° |
| C5 | N4 | C23 | C16 | 179.3° | 179.9° |
| N4 | C5 | H51 | H52 | 121.4° | 119.5° |
| O1 | C37 | O2 | C10 | 10.4° | 0.0° |
| O1 | C37 | O2 | N2 | 179.3° | 180.0° |
| O1 | C37 | N2 | C22 | 58.0° | 2.2° |
| O1 | C37 | N2 | C26 | 117.1° | 180.0° |
| O2 | C10 | C9 | C11 | 179.6° | 180.0° |
| O2 | C10 | C9 | C8 | 179.3° | 180.0° |
| C10 | O2 | C37 | N2 | 170.3° | 180.0° |
| O2 | C10 | C9 | H9 | 0.7° | 0.0° |
| O2 | C10 | C11 | C12 | 179.4° | 179.9° |
| O2 | C10 | C11 | H11 | 0.6° | 0.0° |
| C37 | O2 | C10 | C9 | 166.1° | 89.9° |
| C37 | O2 | C10 | C11 | 14.3° | 90.0° |
| O2 | C37 | N2 | C22 | 122.7° | 177.8° |
| O2 | C37 | N2 | C26 | 62.2° | 0.0° |
| O18 | C23 | C16 | C15 | 179.9° | 179.9° |
| O18 | C23 | C16 | C17 | 0.3° | 0.7° |
| C17 | O19 | C21 | O22 | 179.8° | 172.3° |
| O19 | C17 | C16 | C15 | 0.4° | 22.8° |
| O19 | C17 | C16 | C23 | 180.0° | 158.0° |
| O19 | C17 | C16 | H171 | 125.3° | 122.1° |
| O19 | C17 | C16 | H172 | 125.3° | 118.6° |
| O19 | C17 | H171 | H172 | 116.3° | 113.7° |
| C17 | O19 | C21 | C20 | 0.4° | 10.1° |
| O19 | C21 | O22 | C20 | 179.8° | 177.4° |
| O19 | C21 | C20 | O23 | 121.6° | 151.7° |
| C21 | O19 | C17 | C16 | 0.1° | 17.8° |
| O19 | C21 | C20 | C15 | 0.8° | 32.8° |
| C21 | O19 | C17 | H171 | 125.1° | 105.8° |
| C21 | O19 | C17 | H172 | 125.4° | 139.0° |
| O19 | C21 | C20 | C28 | 128.8° | 91.8° |
| O22 | C21 | C20 | O23 | 58.6° | 30.7° |
| O22 | C21 | C20 | C15 | 179.4° | 149.7° |
| O22 | C21 | C20 | C28 | 51.0° | 85.7° |
| O23 | C20 | C15 | C14 | 61.6° | 38.4° |
| O23 | C20 | C15 | C16 | 119.1° | 144.2° |
| O23 | C20 | C15 | C21 | 118.0° | 115.9° |
| O23 | C20 | C15 | C28 | 109.6° | 120.9° |
| O23 | C20 | C21 | C28 | 109.6° | 116.5° |
| O23 | C20 | C28 | C33 | 179.1° | 57.3° |
| O23 | C20 | C28 | H281 | 53.8° | 178.7° |
| O23 | C20 | C28 | H282 | 55.6° | 64.1° |
| H23 | O23 | C20 | C15 | 180.0° | 52.6° |
| H23 | O23 | C20 | C21 | 55.3° | 68.3° |
| H23 | O23 | C20 | C28 | 64.7° | 175.0° |
| C13 | C8 | C9 | C10 | 0.2° | 0.0° |
| C13 | C8 | C7 | C6 | 0.0° | 0.0° |
| C13 | C8 | C7 | C9 | 179.6° | 180.0° |
| C13 | C8 | C7 | C31 | 179.7° | 180.0° |
| C13 | C8 | C9 | H9 | 179.8° | 179.9° |
| C8 | C13 | C12 | C11 | 0.1° | 0.0° |
| C8 | C13 | C12 | H12 | 179.8° | 179.9° |
| C13 | C12 | C11 | C10 | 0.0° | 0.1° |
| C12 | C13 | C8 | C7 | 179.7° | 180.0° |
| C12 | C13 | C8 | C9 | 0.1° | 0.0° |
| C13 | C12 | C11 | H12 | 180.0° | 179.9° |
| C13 | C12 | C11 | H11 | 180.0° | 180.0° |
| C10 | C9 | C8 | C7 | 179.5° | 180.0° |
| C10 | C9 | C8 | H9 | 179.9° | 180.0° |
| C9 | C10 | C11 | C12 | 0.2° | 0.1° |
| C9 | C10 | C11 | H11 | 179.8° | 180.0° |
| C11 | C10 | C9 | C8 | 0.3° | 0.0° |
| C11 | C10 | C9 | H9 | 179.6° | 180.0° |
| C10 | C11 | C12 | H11 | 180.0° | 179.9° |
| C10 | C11 | C12 | H12 | 180.0° | 180.0° |
| C3 | C14 | C15 | H14 | 180.0° | 179.5° |
| C14 | C3 | C2 | C6 | 179.7° | 179.7° |
| C3 | C14 | C15 | C16 | 0.1° | 1.1° |
| C3 | C14 | C15 | C20 | 179.2° | 178.5° |
| C15 | C14 | C3 | C2 | 179.9° | 180.0° |
| C14 | C15 | C16 | C20 | 179.3° | 177.4° |
| C14 | C15 | C16 | C23 | 0.2° | 0.9° |
| C14 | C15 | C16 | C17 | 179.8° | 178.3° |
| C14 | C15 | C20 | C21 | 179.6° | 154.3° |
| C14 | C15 | C20 | C28 | 48.0° | 82.5° |
| H14 | C14 | C3 | C2 | 0.1° | 0.5° |
| H14 | C14 | C15 | C16 | 179.8° | 178.4° |
| H14 | C14 | C15 | C20 | 0.9° | 1.0° |
| C7 | C6 | C2 | C5 | 179.5° | 179.9° |
| C6 | C7 | C8 | C31 | 179.7° | 180.0° |
| C6 | C7 | C8 | C9 | 179.6° | 180.0° |
| C7 | C6 | C2 | C3 | 179.0° | 179.9° |
| C7 | C6 | C5 | H51 | 55.6° | 63.4° |
| C7 | C6 | C5 | H52 | 54.0° | 63.3° |
| C6 | C7 | C31 | C32 | 85.7° | 90.0° |
| C6 | C7 | C31 | H311 | 149.0° | 148.0° |
| C6 | C7 | C31 | H312 | 39.6° | 32.0° |
| C2 | C6 | C7 | C8 | 0.3° | 0.0° |
| C2 | C6 | C7 | C31 | 179.4° | 180.0° |
| C2 | C6 | C5 | H51 | 125.0° | 116.7° |
| C2 | C6 | C5 | H52 | 125.4° | 116.6° |
| C5 | C6 | C7 | C8 | 179.7° | 179.9° |
| C5 | C6 | C7 | C31 | 0.0° | 0.1° |
| C5 | C6 | C2 | C3 | 0.5° | 0.0° |
| C6 | C5 | H51 | H52 | 121.5° | 127.8° |
| C7 | C8 | C9 | H9 | 0.6° | 0.1° |
| C8 | C7 | C31 | C32 | 94.0° | 90.0° |
| C8 | C7 | C31 | H311 | 31.3° | 32.0° |
| C8 | C7 | C31 | H312 | 140.7° | 148.0° |
| C9 | C8 | C7 | C31 | 0.1° | 0.0° |
| C7 | C31 | C32 | H311 | 125.2° | 122.7° |
| C7 | C31 | C32 | H312 | 125.2° | 122.7° |
| C7 | C31 | H311 | H312 | 114.8° | 119.0° |
| C7 | C31 | C32 | H321 | 180.0° | 60.1° |
| C7 | C31 | C32 | H322 | 54.7° | 180.0° |
| C7 | C31 | C32 | H323 | 54.7° | 59.9° |
| C37 | N2 | C22 | C26 | 174.9° | 178.0° |
| C37 | N2 | C26 | C25 | 103.4° | 127.1° |
| C37 | N2 | C22 | C36 | 98.4° | 126.9° |
| C37 | N2 | C22 | H221 | 136.3° | 112.3° |
| C37 | N2 | C22 | H222 | 26.8° | 4.8° |
| C37 | N2 | C26 | H261 | 21.8° | 4.9° |
| C37 | N2 | C26 | H262 | 131.3° | 112.4° |
| H12 | C12 | C11 | H11 | 0.0° | 0.1° |
| C15 | C16 | C23 | C17 | 179.6° | 179.2° |
| C15 | C16 | C17 | H171 | 124.8° | 99.2° |
| C15 | C16 | C17 | H172 | 125.7° | 141.4° |
| C16 | C15 | C20 | C21 | 1.1° | 28.3° |
| C16 | C15 | C20 | C28 | 131.3° | 95.0° |
| C23 | C16 | C15 | C20 | 179.5° | 178.3° |
| C23 | C16 | C17 | H171 | 54.8° | 79.9° |
| C23 | C16 | C17 | H172 | 54.7° | 39.4° |
| C17 | C16 | C15 | C20 | 0.9° | 0.9° |
| C16 | C17 | H171 | H172 | 116.4° | 120.8° |
| C15 | C20 | C21 | C28 | 129.6° | 124.5° |
| C15 | C20 | C28 | C33 | 65.4° | 178.6° |
| C15 | C20 | C28 | H281 | 169.3° | 60.0° |
| C15 | C20 | C28 | H282 | 59.9° | 57.2° |
| C21 | C20 | C28 | C33 | 67.2° | 56.3° |
| C21 | C20 | C28 | H281 | 58.1° | 65.1° |
| C21 | C20 | C28 | H282 | 167.5° | 177.7° |
| C20 | C28 | C33 | H281 | 125.3° | 119.4° |
| C20 | C28 | C33 | H282 | 125.3° | 119.4° |
| C20 | C28 | H281 | H282 | 115.3° | 116.3° |
| C20 | C28 | C33 | H331 | 180.0° | 60.3° |
| C20 | C28 | C33 | H332 | 54.7° | 60.3° |
| C20 | C28 | C33 | H333 | 54.8° | 180.0° |
| C33 | C28 | H281 | H282 | 115.4° | 122.4° |
| C28 | C33 | H331 | H332 | 125.3° | 122.8° |
| C28 | C33 | H331 | H333 | 125.2° | 120.3° |
| C28 | C33 | H332 | H333 | 115.3° | 120.3° |
| H281 | C28 | C33 | H331 | 54.7° | 59.1° |
| H281 | C28 | C33 | H332 | 180.0° | 179.7° |
| H281 | C28 | C33 | H333 | 70.5° | 60.6° |
| H282 | C28 | C33 | H331 | 54.8° | 179.7° |
| H282 | C28 | C33 | H332 | 70.5° | 59.1° |
| H282 | C28 | C33 | H333 | 180.0° | 60.6° |
| C32 | C31 | H311 | H312 | 114.9° | 117.1° |
| C31 | C32 | H321 | H322 | 125.2° | 121.5° |
| C31 | C32 | H321 | H323 | 125.3° | 121.9° |
| C31 | C32 | H322 | H323 | 114.8° | 121.8° |
| H311 | C31 | C32 | H321 | 54.8° | 177.3° |
| H311 | C31 | C32 | H322 | 180.0° | 57.3° |
| H311 | C31 | C32 | H323 | 70.5° | 62.7° |
| H312 | C31 | C32 | H321 | 54.7° | 62.6° |
| H312 | C31 | C32 | H322 | 70.5° | 57.4° |
| H312 | C31 | C32 | H323 | 180.0° | 177.4° |
| H321 | C32 | H322 | H323 | 114.9° | 116.5° |
| H331 | C33 | H332 | H333 | 115.4° | 116.9° |
| C22 | N2 | C26 | C25 | 73.5° | 55.0° |
| N2 | C22 | C36 | H221 | 125.3° | 118.9° |
| N2 | C22 | C36 | H222 | 125.3° | 122.7° |
| N2 | C22 | H221 | H222 | 128.6° | 119.1° |
| N2 | C22 | C36 | C24 | 91.4° | 53.7° |
| C22 | N2 | C26 | H261 | 161.3° | 177.2° |
| C22 | N2 | C26 | H262 | 51.7° | 65.5° |
| N2 | C22 | C36 | H11A | 143.5° | 67.3° |
| N2 | C22 | C36 | H12A | 34.9° | 175.8° |
| N2 | C26 | C25 | C24 | 59.3° | 53.6° |
| N2 | C26 | C25 | H261 | 125.2° | 123.4° |
| N2 | C26 | C25 | H262 | 125.3° | 118.6° |
| N2 | C26 | C25 | H251 | 175.4° | 175.7° |
| N2 | C26 | C25 | H252 | 66.0° | 67.4° |
| C26 | N2 | C22 | C36 | 76.5° | 55.1° |
| C26 | N2 | C22 | H221 | 48.8° | 65.7° |
| C26 | N2 | C22 | H222 | 158.3° | 177.3° |
| N2 | C26 | H261 | H262 | 120.1° | 117.2° |
| C24 | N3 | C29 | C35 | 123.6° | 123.1° |
| N3 | C24 | C25 | C36 | 5.8° | 121.8° |
| N3 | C24 | C25 | H24 | 177.0° | 118.4° |
| N3 | C24 | C25 | C26 | 177.4° | 176.3° |
| N3 | C24 | C25 | H251 | 57.3° | 62.1° |
| N3 | C24 | C25 | H252 | 52.2° | 55.7° |
| N3 | C24 | C36 | C22 | 105.6° | 176.3° |
| N3 | C24 | C36 | H24 | 25.2° | 118.4° |
| C24 | N3 | C29 | C34 | 163.8° | 178.0° |
| C24 | N3 | C29 | H291 | 71.0° | 59.8° |
| C24 | N3 | C29 | H292 | 38.6° | 58.3° |
| C24 | N3 | C35 | C27 | 178.7° | 178.0° |
| C24 | N3 | C35 | H351 | 53.5° | 58.3° |
| C24 | N3 | C35 | H352 | 56.1° | 59.8° |
| N3 | C24 | C36 | H11A | 18.8° | 55.7° |
| N3 | C24 | C36 | H12A | 129.9° | 62.1° |
| C29 | N3 | C24 | C25 | 164.8° | 180.0° |
| C29 | N3 | C24 | C36 | 146.2° | 58.0° |
| C29 | N3 | C24 | H24 | 19.8° | 61.0° |
| N3 | C29 | C34 | H291 | 125.2° | 122.8° |
| N3 | C29 | C34 | H292 | 125.3° | 120.5° |
| N3 | C29 | H291 | H292 | 119.3° | 119.5° |
| N3 | C29 | C34 | C30 | 65.6° | 55.8° |
| N3 | C29 | C34 | H341 | 169.1° | 177.5° |
| N3 | C29 | C34 | H342 | 59.6° | 65.4° |
| C29 | N3 | C35 | C27 | 57.2° | 58.9° |
| C29 | N3 | C35 | H351 | 177.6° | 178.6° |
| C29 | N3 | C35 | H352 | 68.0° | 63.3° |
| C35 | N3 | C24 | C25 | 74.1° | 56.5° |
| C35 | N3 | C24 | C36 | 92.7° | 178.5° |
| C35 | N3 | C24 | H24 | 101.3° | 62.5° |
| C35 | N3 | C29 | C34 | 72.6° | 58.9° |
| C35 | N3 | C29 | H291 | 52.6° | 63.3° |
| C35 | N3 | C29 | H292 | 162.2° | 178.6° |
| N3 | C35 | C27 | H351 | 125.2° | 120.4° |
| N3 | C35 | C27 | H352 | 125.3° | 122.8° |
| N3 | C35 | H351 | H352 | 116.2° | 120.2° |
| N3 | C35 | C27 | C30 | 36.7° | 55.9° |
| N3 | C35 | C27 | H271 | 88.5° | 65.4° |
| N3 | C35 | C27 | H272 | 162.0° | 177.4° |
| C24 | C25 | C26 | H251 | 125.3° | 122.0° |
| C24 | C25 | C26 | H252 | 125.2° | 121.1° |
| C24 | C25 | H251 | H252 | 117.3° | 119.5° |
| C25 | C24 | C36 | C22 | 91.8° | 54.5° |
| C25 | C24 | C36 | H24 | 172.2° | 119.8° |
| C24 | C25 | C26 | H261 | 175.5° | 177.0° |
| C24 | C25 | C26 | H262 | 66.0° | 65.0° |
| C25 | C24 | C36 | H11A | 143.8° | 66.0° |
| C25 | C24 | C36 | H12A | 32.7° | 176.1° |
| C26 | C25 | H251 | H252 | 117.4° | 118.0° |
| C26 | C25 | C24 | C36 | 171.6° | 54.5° |
| C26 | C25 | C24 | H24 | 5.5° | 65.3° |
| C25 | C26 | H261 | H262 | 120.0° | 119.9° |
| H251 | C25 | C24 | C36 | 63.0° | 176.1° |
| H251 | C25 | C24 | H24 | 119.8° | 56.3° |
| H251 | C25 | C26 | H261 | 50.2° | 60.9° |
| H251 | C25 | C26 | H262 | 59.3° | 57.1° |
| H252 | C25 | C24 | C36 | 46.4° | 66.0° |
| H252 | C25 | C24 | H24 | 130.8° | 174.2° |
| H252 | C25 | C26 | H261 | 59.2° | 55.9° |
| H252 | C25 | C26 | H262 | 168.8° | 174.0° |
| C36 | C22 | H221 | H222 | 128.5° | 119.8° |
| C22 | C36 | C24 | H11A | 124.4° | 120.6° |
| C22 | C36 | C24 | H12A | 124.6° | 121.6° |
| C22 | C36 | C24 | H24 | 80.4° | 65.3° |
| C22 | C36 | H11A | H12A | 144.5° | 118.4° |
| H221 | C22 | C36 | C24 | 33.9° | 65.2° |
| H221 | C22 | C36 | H11A | 91.2° | 173.8° |
| H221 | C22 | C36 | H12A | 160.2° | 56.9° |
| H222 | C22 | C36 | C24 | 143.4° | 176.4° |
| H222 | C22 | C36 | H11A | 18.2° | 55.3° |
| H222 | C22 | C36 | H12A | 90.3° | 61.5° |
| C24 | C36 | H11A | H12A | 146.0° | 119.9° |
| H24 | C24 | C36 | H11A | 43.9° | 174.1° |
| H24 | C24 | C36 | H12A | 155.0° | 56.3° |
| C34 | C29 | H291 | H292 | 119.1° | 117.5° |
| C29 | C34 | C30 | H341 | 125.3° | 121.7° |
| C29 | C34 | C30 | H342 | 125.3° | 121.2° |
| C29 | C34 | H341 | H342 | 118.0° | 118.7° |
| C29 | C34 | C30 | C27 | 45.4° | 52.4° |
| C29 | C34 | C30 | H301 | 79.9° | 174.1° |
| C29 | C34 | C30 | H302 | 170.6° | 68.3° |
| H291 | C29 | C34 | C30 | 59.6° | 67.0° |
| H291 | C29 | C34 | H341 | 65.7° | 54.7° |
| H291 | C29 | C34 | H342 | 175.1° | 171.8° |
| H292 | C29 | C34 | C30 | 169.1° | 176.2° |
| H292 | C29 | C34 | H341 | 43.8° | 62.1° |
| H292 | C29 | C34 | H342 | 65.6° | 55.0° |
| C30 | C34 | H341 | H342 | 117.9° | 118.6° |
| C34 | C30 | C27 | C35 | 29.5° | 52.4° |
| C34 | C30 | C27 | H301 | 125.3° | 121.7° |
| C34 | C30 | C27 | H302 | 125.2° | 120.7° |
| C34 | C30 | C27 | H271 | 95.8° | 69.0° |
| C34 | C30 | C27 | H272 | 154.8° | 174.0° |
| C34 | C30 | H301 | H302 | 115.9° | 119.0° |
| H341 | C34 | C30 | C27 | 170.7° | 174.0° |
| H341 | C34 | C30 | H301 | 45.4° | 64.2° |
| H341 | C34 | C30 | H302 | 64.1° | 53.3° |
| H342 | C34 | C30 | C27 | 80.0° | 68.9° |
| H342 | C34 | C30 | H301 | 154.8° | 52.8° |
| H342 | C34 | C30 | H302 | 45.3° | 170.4° |
| C27 | C35 | H351 | H352 | 116.2° | 118.4° |
| C35 | C27 | C30 | H271 | 125.3° | 121.3° |
| C35 | C27 | C30 | H272 | 125.3° | 121.6° |
| C35 | C27 | H271 | H272 | 116.4° | 118.8° |
| C35 | C27 | C30 | H301 | 95.8° | 174.1° |
| C35 | C27 | C30 | H302 | 154.7° | 68.3° |
| H351 | C35 | C27 | C30 | 162.0° | 176.2° |
| H351 | C35 | C27 | H271 | 36.7° | 54.9° |
| H351 | C35 | C27 | H272 | 72.8° | 62.2° |
| H352 | C35 | C27 | C30 | 88.5° | 66.9° |
| H352 | C35 | C27 | H271 | 146.3° | 171.8° |
| H352 | C35 | C27 | H272 | 36.8° | 54.7° |
| C30 | C27 | H271 | H272 | 116.3° | 118.8° |
| C27 | C30 | H301 | H302 | 115.9° | 119.0° |
| H271 | C27 | C30 | H301 | 138.9° | 52.8° |
| H271 | C27 | C30 | H302 | 29.4° | 170.3° |
| H272 | C27 | C30 | H301 | 29.5° | 64.3° |
| H272 | C27 | C30 | H302 | 80.0° | 53.3° |
