COJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O44 | C43 | doub | 1.21Å | 1.29Å | |
| C13 | C48 | sing | 1.53Å | 1.61Å | |
| C13 | C14 | sing | 1.52Å | 1.59Å | |
| C13 | C12 | sing | 1.54Å | 1.58Å | |
| C13 | H13 | sing | 1.09Å | 1.11Å | |
| C48 | C49 | sing | 1.53Å | 1.55Å | |
| C48 | H481 | sing | 1.09Å | 1.12Å | |
| C48 | H482 | sing | 1.09Å | 1.12Å | |
| C49 | C50 | sing | 1.51Å | 1.52Å | |
| C49 | H491 | sing | 1.09Å | 1.12Å | |
| C49 | H492 | sing | 1.09Å | 1.11Å | |
| C50 | O51 | doub | 1.21Å | 1.26Å | |
| C50 | O52 | sing | 1.34Å | 1.28Å | |
| O52 | H52 | sing | 0.97Å | 0.95Å | |
| C14 | C15 | doub | 1.36Å | 1.45Å | |
| C14 | N23 | sing | 1.33Å | 1.30Å | |
| C43 | O45 | sing | 1.34Å | 1.28Å | |
| C43 | C42 | sing | 1.51Å | 1.54Å | |
| O45 | H45 | sing | 0.97Å | 0.95Å | |
| C9 | C10 | doub | 1.37Å | 1.34Å | |
| C9 | N22 | sing | 1.33Å | 1.39Å | |
| C9 | C8 | sing | 1.52Å | 1.52Å | |
| C10 | C11 | sing | 1.39Å | 1.36Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | C12 | sing | 1.52Å | 1.53Å | |
| C11 | N23 | doub | 1.31Å | 1.28Å | |
| C12 | C46 | sing | 1.53Å | 1.57Å | |
| C12 | C47 | sing | 1.53Å | 1.56Å | |
| C46 | H461 | sing | 1.09Å | 1.11Å | |
| C46 | H462 | sing | 1.09Å | 1.11Å | |
| C46 | H463 | sing | 1.09Å | 1.12Å | |
| C47 | H471 | sing | 1.09Å | 1.12Å | |
| C47 | H472 | sing | 1.09Å | 1.12Å | |
| C47 | H473 | sing | 1.09Å | 1.11Å | |
| C18 | C60 | sing | 1.53Å | 1.57Å | |
| C18 | C19 | sing | 1.55Å | 1.55Å | |
| C18 | C17 | sing | 1.55Å | 1.65Å | |
| C18 | H18 | sing | 1.09Å | 1.12Å | |
| C60 | C61 | sing | 1.51Å | 1.53Å | |
| C60 | H601 | sing | 1.09Å | 1.11Å | |
| C60 | H602 | sing | 1.09Å | 1.11Å | |
| C61 | O63 | sing | 1.34Å | 1.28Å | |
| C61 | O62 | doub | 1.21Å | 1.27Å | |
| O63 | H63 | sing | 0.97Å | 0.95Å | |
| C19 | N24 | sing | 1.47Å | 1.51Å | |
| C19 | C1 | sing | 1.53Å | 1.63Å | |
| C19 | H19 | sing | 1.08Å | 1.11Å | |
| O58 | C57 | doub | 1.21Å | 1.23Å | |
| C15 | C16 | sing | 1.41Å | 1.46Å | |
| C15 | C64 | sing | 1.51Å | 1.56Å | |
| O59 | C57 | sing | 1.34Å | 1.24Å | |
| O59 | H59 | sing | 0.97Å | 0.95Å | |
| C16 | C17 | sing | 1.52Å | 1.63Å | |
| C16 | N24 | doub | 1.29Å | 1.28Å | |
| C17 | C54 | sing | 1.53Å | 1.58Å | |
| C17 | C55 | sing | 1.53Å | 1.63Å | |
| C54 | H541 | sing | 1.09Å | 1.12Å | |
| C54 | H542 | sing | 1.09Å | 1.12Å | |
| C54 | H543 | sing | 1.09Å | 1.11Å | |
| C55 | C56 | sing | 1.53Å | 1.56Å | |
| C55 | H551 | sing | 1.09Å | 1.12Å | |
| C55 | H552 | sing | 1.09Å | 1.11Å | |
| C56 | C57 | sing | 1.51Å | 1.54Å | |
| C56 | H561 | sing | 1.09Å | 1.11Å | |
| C56 | H562 | sing | 1.09Å | 1.12Å | |
| C42 | C41 | sing | 1.53Å | 1.55Å | |
| C42 | H421 | sing | 1.09Å | 1.12Å | |
| C42 | H422 | sing | 1.09Å | 1.11Å | |
| C25 | C2 | sing | 1.53Å | 1.59Å | |
| C25 | H251 | sing | 1.09Å | 1.12Å | |
| C25 | H252 | sing | 1.09Å | 1.11Å | |
| C25 | H253 | sing | 1.09Å | 1.11Å | |
| C26 | C27 | sing | 1.51Å | 1.57Å | |
| C26 | C2 | sing | 1.53Å | 1.64Å | |
| C26 | H261 | sing | 1.09Å | 1.12Å | |
| C26 | H262 | sing | 1.09Å | 1.11Å | |
| C27 | O28 | doub | 1.21Å | 1.27Å | |
| C27 | O29 | sing | 1.34Å | 1.26Å | |
| O29 | H29 | sing | 0.97Å | 0.95Å | |
| C3 | C30 | sing | 1.53Å | 1.61Å | |
| C3 | C2 | sing | 1.54Å | 1.60Å | |
| C3 | C4 | sing | 1.52Å | 1.58Å | |
| C3 | H31 | sing | 1.09Å | 1.11Å | |
| C30 | C31 | sing | 1.53Å | 1.57Å | |
| C30 | H301 | sing | 1.09Å | 1.12Å | |
| C30 | H302 | sing | 1.09Å | 1.12Å | |
| C2 | C1 | sing | 1.54Å | 1.54Å | |
| C64 | H641 | sing | 1.09Å | 1.11Å | |
| C64 | H642 | sing | 1.09Å | 1.12Å | |
| C64 | H643 | sing | 1.09Å | 1.12Å | |
| N21 | C1 | sing | 1.46Å | 1.47Å | |
| N21 | C4 | sing | 1.36Å | 1.27Å | |
| N21 | H21 | sing | 0.97Å | 1.02Å | |
| N22 | C6 | doub | 1.31Å | 1.43Å | |
| C1 | C20 | sing | 1.53Å | 1.59Å | |
| C20 | H201 | sing | 1.09Å | 1.12Å | |
| C20 | H202 | sing | 1.09Å | 1.12Å | |
| C20 | H203 | sing | 1.09Å | 1.11Å | |
| C31 | C32 | sing | 1.51Å | 1.58Å | |
| C31 | H311 | sing | 1.09Å | 1.12Å | |
| C31 | H312 | sing | 1.09Å | 1.12Å | |
| C36 | C7 | sing | 1.53Å | 1.57Å | |
| C36 | H361 | sing | 1.09Å | 1.12Å | |
| C36 | H362 | sing | 1.09Å | 1.11Å | |
| C36 | H363 | sing | 1.09Å | 1.12Å | |
| C37 | C38 | sing | 1.51Å | 1.53Å | |
| C37 | C7 | sing | 1.53Å | 1.56Å | |
| C37 | H371 | sing | 1.09Å | 1.12Å | |
| C37 | H372 | sing | 1.09Å | 1.11Å | |
| C38 | O39 | doub | 1.21Å | 1.25Å | |
| C38 | O40 | sing | 1.34Å | 1.28Å | |
| O40 | H40 | sing | 0.97Å | 0.95Å | |
| C8 | C41 | sing | 1.53Å | 1.59Å | |
| C8 | C7 | sing | 1.54Å | 1.60Å | |
| C8 | H8 | sing | 1.09Å | 1.12Å | |
| C41 | H411 | sing | 1.09Å | 1.11Å | |
| C41 | H412 | sing | 1.09Å | 1.12Å | |
| C7 | C6 | sing | 1.51Å | 1.58Å | |
| C32 | O34 | sing | 1.34Å | 1.30Å | |
| C32 | O33 | doub | 1.21Å | 1.29Å | |
| O34 | H34 | sing | 0.97Å | 0.95Å | |
| C4 | C5 | doub | 1.36Å | 1.38Å | |
| C5 | C35 | sing | 1.51Å | 1.53Å | |
| C5 | C6 | sing | 1.40Å | 1.41Å | |
| C35 | H351 | sing | 1.09Å | 1.12Å | |
| C35 | H352 | sing | 1.09Å | 1.12Å | |
| C35 | H353 | sing | 1.09Å | 1.11Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O44 | C43 | O45 | 121.8° | 120.0° |
| O44 | C43 | C42 | 119.8° | 120.0° |
| C48 | C13 | C14 | 124.4° | 110.8° |
| C48 | C13 | C12 | 108.9° | 110.8° |
| C48 | C13 | H13 | 97.2° | 110.7° |
| C13 | C48 | C49 | 124.1° | 109.5° |
| C13 | C48 | H481 | 107.0° | 109.5° |
| C13 | C48 | H482 | 107.0° | 109.5° |
| C14 | C13 | C12 | 102.4° | 103.0° |
| C14 | C13 | H13 | 104.4° | 110.7° |
| C13 | C14 | C15 | 131.3° | 122.9° |
| C13 | C14 | N23 | 107.9° | 108.9° |
| C12 | C13 | H13 | 121.2° | 110.7° |
| C13 | C12 | C11 | 100.1° | 103.2° |
| C13 | C12 | C46 | 119.6° | 110.7° |
| C13 | C12 | C47 | 109.0° | 110.7° |
| C49 | C48 | H481 | 107.0° | 109.5° |
| C49 | C48 | H482 | 107.0° | 109.5° |
| C48 | C49 | C50 | 111.6° | 109.4° |
| C48 | C49 | H491 | 111.4° | 109.4° |
| C48 | C49 | H492 | 111.4° | 109.5° |
| H481 | C48 | H482 | 102.6° | 109.4° |
| C50 | C49 | H491 | 111.4° | 109.5° |
| C50 | C49 | H492 | 111.4° | 109.5° |
| C49 | C50 | O51 | 118.6° | 120.0° |
| C49 | C50 | O52 | 118.5° | 120.0° |
| H491 | C49 | H492 | 99.0° | 109.5° |
| O51 | C50 | O52 | 122.9° | 120.0° |
| C50 | O52 | H52 | 118.5° | 120.1° |
| C15 | C14 | N23 | 120.8° | 128.1° |
| C14 | C15 | C16 | 132.2° | 122.6° |
| C14 | C15 | C64 | 111.0° | 118.6° |
| C14 | N23 | C11 | 116.4° | 115.5° |
| O45 | C43 | C42 | 118.4° | 120.0° |
| C43 | O45 | H45 | 121.8° | 120.0° |
| C43 | C42 | C41 | 116.0° | 109.5° |
| C43 | C42 | H421 | 109.8° | 109.4° |
| C43 | C42 | H422 | 109.8° | 109.5° |
| C10 | C9 | N22 | 122.7° | 127.5° |
| C10 | C9 | C8 | 126.3° | 123.9° |
| C9 | C10 | C11 | 139.0° | 124.2° |
| C9 | C10 | H10 | 109.0° | 117.5° |
| N22 | C9 | C8 | 110.9° | 108.6° |
| C9 | N22 | C6 | 113.1° | 115.2° |
| C9 | C8 | C41 | 111.2° | 110.8° |
| C9 | C8 | C7 | 101.7° | 102.8° |
| C9 | C8 | H8 | 115.0° | 110.8° |
| C11 | C10 | H10 | 112.1° | 118.4° |
| C10 | C11 | C12 | 121.6° | 123.4° |
| C10 | C11 | N23 | 125.2° | 127.4° |
| C12 | C11 | N23 | 113.2° | 109.2° |
| C11 | C12 | C46 | 111.1° | 110.7° |
| C11 | C12 | C47 | 109.5° | 110.7° |
| C46 | C12 | C47 | 107.2° | 110.6° |
| C12 | C46 | H461 | 119.5° | 109.5° |
| C12 | C46 | H462 | 108.6° | 109.4° |
| C12 | C46 | H463 | 108.6° | 109.4° |
| C12 | C47 | H471 | 109.0° | 109.4° |
| C12 | C47 | H472 | 112.4° | 109.5° |
| C12 | C47 | H473 | 112.4° | 109.5° |
| H461 | C46 | H462 | 108.7° | 109.5° |
| H461 | C46 | H463 | 108.5° | 109.5° |
| H462 | C46 | H463 | 101.4° | 109.5° |
| H471 | C47 | H472 | 112.3° | 109.5° |
| H471 | C47 | H473 | 112.4° | 109.5° |
| H472 | C47 | H473 | 98.0° | 109.4° |
| C60 | C18 | C19 | 112.5° | 111.4° |
| C60 | C18 | C17 | 127.6° | 111.2° |
| C60 | C18 | H18 | 90.6° | 111.0° |
| C18 | C60 | C61 | 120.9° | 109.5° |
| C18 | C60 | H601 | 108.1° | 109.4° |
| C18 | C60 | H602 | 108.1° | 109.5° |
| C19 | C18 | C17 | 104.7° | 100.3° |
| C19 | C18 | H18 | 120.6° | 111.2° |
| C18 | C19 | N24 | 100.9° | 104.8° |
| C18 | C19 | C1 | 119.5° | 110.5° |
| C18 | C19 | H19 | 111.9° | 110.3° |
| C17 | C18 | H18 | 101.1° | 111.2° |
| C18 | C17 | C16 | 101.9° | 103.1° |
| C18 | C17 | C54 | 110.8° | 110.7° |
| C18 | C17 | C55 | 110.9° | 110.9° |
| C61 | C60 | H601 | 108.2° | 109.5° |
| C61 | C60 | H602 | 108.2° | 109.5° |
| C60 | C61 | O63 | 118.9° | 120.0° |
| C60 | C61 | O62 | 118.2° | 120.0° |
| H601 | C60 | H602 | 101.8° | 109.5° |
| O63 | C61 | O62 | 122.8° | 120.0° |
| C61 | O63 | H63 | 118.9° | 120.0° |
| N24 | C19 | C1 | 116.9° | 109.0° |
| N24 | C19 | H19 | 114.7° | 111.2° |
| C19 | N24 | C16 | 121.7° | 112.0° |
| C1 | C19 | H19 | 93.7° | 110.9° |
| C19 | C1 | C2 | 130.7° | 111.9° |
| C19 | C1 | N21 | 107.3° | 109.8° |
| C19 | C1 | C20 | 109.3° | 109.9° |
| O58 | C57 | O59 | 120.0° | 120.0° |
| O58 | C57 | C56 | 120.1° | 120.0° |
| C16 | C15 | C64 | 116.8° | 118.8° |
| C15 | C16 | C17 | 136.5° | 123.3° |
| C15 | C16 | N24 | 118.1° | 126.2° |
| C15 | C64 | H641 | 111.0° | 109.5° |
| C15 | C64 | H642 | 111.6° | 109.5° |
| C15 | C64 | H643 | 111.6° | 109.4° |
| C57 | O59 | H59 | 120.0° | 120.0° |
| O59 | C57 | C56 | 119.9° | 120.0° |
| C17 | C16 | N24 | 105.4° | 110.5° |
| C16 | C17 | C54 | 104.3° | 110.7° |
| C16 | C17 | C55 | 125.3° | 110.7° |
| C54 | C17 | C55 | 103.3° | 110.6° |
| C17 | C54 | H541 | 110.8° | 109.5° |
| C17 | C54 | H542 | 111.7° | 109.4° |
| C17 | C54 | H543 | 111.7° | 109.5° |
| C17 | C55 | C56 | 125.0° | 109.4° |
| C17 | C55 | H551 | 106.7° | 109.5° |
| C17 | C55 | H552 | 106.7° | 109.5° |
| H541 | C54 | H542 | 111.7° | 109.4° |
| H541 | C54 | H543 | 111.8° | 109.5° |
| H542 | C54 | H543 | 98.7° | 109.5° |
| C56 | C55 | H551 | 106.7° | 109.4° |
| C56 | C55 | H552 | 106.8° | 109.5° |
| C55 | C56 | C57 | 116.8° | 109.5° |
| C55 | C56 | H561 | 109.6° | 109.5° |
| C55 | C56 | H562 | 109.5° | 109.5° |
| H551 | C55 | H552 | 102.9° | 109.5° |
| C57 | C56 | H561 | 109.5° | 109.4° |
| C57 | C56 | H562 | 109.6° | 109.5° |
| H561 | C56 | H562 | 100.6° | 109.4° |
| C41 | C42 | H421 | 109.8° | 109.5° |
| C41 | C42 | H422 | 109.9° | 109.5° |
| C42 | C41 | C8 | 116.9° | 109.5° |
| C42 | C41 | H411 | 109.5° | 109.4° |
| C42 | C41 | H412 | 109.5° | 109.5° |
| H421 | C42 | H422 | 100.4° | 109.4° |
| C2 | C25 | H251 | 105.5° | 109.4° |
| C2 | C25 | H252 | 113.7° | 109.5° |
| C2 | C25 | H253 | 113.7° | 109.5° |
| C25 | C2 | C26 | 105.5° | 110.7° |
| C25 | C2 | C3 | 115.4° | 110.8° |
| C25 | C2 | C1 | 128.6° | 110.8° |
| H251 | C25 | H252 | 113.7° | 109.5° |
| H251 | C25 | H253 | 113.7° | 109.4° |
| H252 | C25 | H253 | 96.8° | 109.5° |
| C27 | C26 | C2 | 124.8° | 109.5° |
| C27 | C26 | H261 | 106.8° | 109.4° |
| C27 | C26 | H262 | 106.8° | 109.5° |
| C26 | C27 | O28 | 118.8° | 120.0° |
| C26 | C27 | O29 | 120.3° | 120.0° |
| C2 | C26 | H261 | 106.8° | 109.5° |
| C2 | C26 | H262 | 106.8° | 109.5° |
| C26 | C2 | C3 | 107.1° | 110.7° |
| C26 | C2 | C1 | 87.9° | 110.8° |
| H261 | C26 | H262 | 102.7° | 109.4° |
| O28 | C27 | O29 | 120.9° | 120.0° |
| C27 | O29 | H29 | 120.3° | 120.0° |
| C30 | C3 | C2 | 117.6° | 110.7° |
| C30 | C3 | C4 | 111.3° | 110.7° |
| C30 | C3 | H31 | 100.4° | 110.6° |
| C3 | C30 | C31 | 118.8° | 109.5° |
| C3 | C30 | H301 | 108.8° | 109.5° |
| C3 | C30 | H302 | 108.8° | 109.4° |
| C2 | C3 | C4 | 102.1° | 103.1° |
| C2 | C3 | H31 | 109.9° | 110.7° |
| C3 | C2 | C1 | 106.8° | 102.9° |
| C4 | C3 | H31 | 116.3° | 110.7° |
| C3 | C4 | N21 | 108.4° | 109.6° |
| C3 | C4 | C5 | 131.0° | 124.8° |
| C31 | C30 | H301 | 108.9° | 109.5° |
| C31 | C30 | H302 | 108.9° | 109.5° |
| C30 | C31 | C32 | 115.4° | 109.5° |
| C30 | C31 | H311 | 110.0° | 109.5° |
| C30 | C31 | H312 | 110.0° | 109.5° |
| H301 | C30 | H302 | 101.2° | 109.5° |
| C2 | C1 | N21 | 102.2° | 106.0° |
| C2 | C1 | C20 | 102.0° | 109.5° |
| H641 | C64 | H642 | 111.7° | 109.5° |
| H641 | C64 | H643 | 111.7° | 109.5° |
| H642 | C64 | H643 | 98.7° | 109.5° |
| C1 | N21 | C4 | 120.5° | 111.2° |
| C1 | N21 | H21 | 108.3° | 124.4° |
| N21 | C1 | C20 | 101.8° | 109.7° |
| C4 | N21 | H21 | 108.3° | 124.4° |
| N21 | C4 | C5 | 120.6° | 125.6° |
| N22 | C6 | C7 | 105.4° | 109.3° |
| N22 | C6 | C5 | 120.4° | 126.1° |
| C1 | C20 | H201 | 109.3° | 109.5° |
| C1 | C20 | H202 | 112.3° | 109.5° |
| C1 | C20 | H203 | 112.2° | 109.5° |
| H201 | C20 | H202 | 112.2° | 109.5° |
| H201 | C20 | H203 | 112.3° | 109.4° |
| H202 | C20 | H203 | 98.2° | 109.5° |
| C32 | C31 | H311 | 110.1° | 109.5° |
| C32 | C31 | H312 | 110.1° | 109.5° |
| C31 | C32 | O34 | 119.2° | 120.0° |
| C31 | C32 | O33 | 118.8° | 120.0° |
| H311 | C31 | H312 | 100.2° | 109.4° |
| C7 | C36 | H361 | 110.5° | 109.5° |
| C7 | C36 | H362 | 111.8° | 109.4° |
| C7 | C36 | H363 | 111.8° | 109.5° |
| C36 | C7 | C37 | 110.6° | 110.6° |
| C36 | C7 | C8 | 114.6° | 110.7° |
| C36 | C7 | C6 | 111.9° | 110.7° |
| H361 | C36 | H362 | 111.8° | 109.5° |
| H361 | C36 | H363 | 111.8° | 109.5° |
| H362 | C36 | H363 | 98.7° | 109.5° |
| C38 | C37 | C7 | 118.5° | 109.4° |
| C38 | C37 | H371 | 109.0° | 109.5° |
| C38 | C37 | H372 | 109.0° | 109.5° |
| C37 | C38 | O39 | 119.1° | 120.0° |
| C37 | C38 | O40 | 118.1° | 120.0° |
| C7 | C37 | H371 | 109.0° | 109.5° |
| C7 | C37 | H372 | 108.9° | 109.5° |
| C37 | C7 | C8 | 106.8° | 110.7° |
| C37 | C7 | C6 | 108.8° | 110.7° |
| H371 | C37 | H372 | 101.1° | 109.5° |
| O39 | C38 | O40 | 122.8° | 120.0° |
| C38 | O40 | H40 | 118.1° | 120.0° |
| C41 | C8 | C7 | 113.8° | 110.8° |
| C41 | C8 | H8 | 103.1° | 110.6° |
| C8 | C41 | H411 | 109.6° | 109.4° |
| C8 | C41 | H412 | 109.5° | 109.5° |
| C7 | C8 | H8 | 112.4° | 110.8° |
| C8 | C7 | C6 | 103.7° | 103.2° |
| H411 | C41 | H412 | 100.6° | 109.5° |
| C7 | C6 | C5 | 134.1° | 124.6° |
| O34 | C32 | O33 | 122.0° | 120.0° |
| C32 | O34 | H34 | 119.2° | 120.0° |
| C4 | C5 | C35 | 112.3° | 119.9° |
| C4 | C5 | C6 | 131.2° | 119.7° |
| C35 | C5 | C6 | 116.4° | 120.4° |
| C5 | C35 | H351 | 112.3° | 109.5° |
| C5 | C35 | H352 | 111.1° | 109.5° |
| C5 | C35 | H353 | 111.2° | 109.4° |
| H351 | C35 | H352 | 111.2° | 109.5° |
| H351 | C35 | H353 | 111.2° | 109.5° |
| H352 | C35 | H353 | 99.2° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O44 | C43 | O45 | C42 | 177.5° | 179.9° |
| O44 | C43 | O45 | H45 | 180.0° | 0.1° |
| O44 | C43 | C42 | C41 | 15.9° | 0.1° |
| O44 | C43 | C42 | H421 | 109.4° | 120.1° |
| O44 | C43 | C42 | H422 | 141.1° | 120.0° |
| C48 | C13 | C14 | C12 | 123.5° | 118.4° |
| C48 | C13 | C14 | H13 | 109.4° | 123.2° |
| C48 | C13 | C12 | H13 | 111.2° | 123.1° |
| C13 | C48 | C49 | H481 | 125.3° | 120.0° |
| C13 | C48 | C49 | H482 | 125.3° | 120.0° |
| C13 | C48 | H481 | H482 | 112.5° | 119.9° |
| C13 | C48 | C49 | C50 | 161.9° | 176.3° |
| C13 | C48 | C49 | H491 | 72.9° | 56.3° |
| C13 | C48 | C49 | H492 | 36.6° | 63.7° |
| C48 | C13 | C14 | C15 | 58.0° | 66.8° |
| C48 | C13 | C14 | N23 | 122.8° | 114.8° |
| C48 | C13 | C12 | C11 | 132.3° | 115.7° |
| C48 | C13 | C12 | C46 | 10.8° | 125.7° |
| C48 | C13 | C12 | C47 | 112.8° | 2.7° |
| C14 | C13 | C12 | H13 | 115.5° | 118.4° |
| C14 | C13 | C48 | C49 | 4.3° | 165.8° |
| C14 | C13 | C48 | H481 | 129.6° | 74.1° |
| C14 | C13 | C48 | H482 | 121.0° | 45.8° |
| C13 | C14 | C15 | N23 | 179.1° | 178.0° |
| C14 | C13 | C12 | C11 | 1.1° | 2.7° |
| C13 | C14 | N23 | C11 | 0.1° | 3.3° |
| C14 | C13 | C12 | C46 | 122.6° | 115.8° |
| C14 | C13 | C12 | C47 | 113.8° | 121.2° |
| C13 | C14 | C15 | C16 | 177.0° | 176.1° |
| C13 | C14 | C15 | C64 | 1.8° | 4.0° |
| C12 | C13 | C48 | C49 | 124.8° | 80.6° |
| C12 | C13 | C48 | H481 | 109.9° | 39.5° |
| C12 | C13 | C48 | H482 | 0.4° | 159.4° |
| C12 | C13 | C14 | C15 | 178.5° | 174.7° |
| C12 | C13 | C14 | N23 | 0.7° | 3.6° |
| C13 | C12 | C11 | C10 | 177.7° | 177.1° |
| C13 | C12 | C11 | C46 | 127.3° | 118.5° |
| C13 | C12 | C11 | C47 | 114.5° | 118.4° |
| C13 | C12 | C11 | N23 | 1.3° | 1.1° |
| C13 | C12 | C46 | C47 | 124.5° | 123.0° |
| C13 | C12 | C46 | H461 | 180.0° | 175.3° |
| C13 | C12 | C46 | H462 | 54.7° | 64.6° |
| C13 | C12 | C46 | H463 | 54.8° | 55.3° |
| C13 | C12 | C47 | H471 | 180.0° | 170.6° |
| C13 | C12 | C47 | H472 | 54.8° | 50.6° |
| C13 | C12 | C47 | H473 | 54.7° | 69.4° |
| H13 | C13 | C48 | C49 | 108.7° | 42.6° |
| H13 | C13 | C48 | H481 | 16.6° | 162.6° |
| H13 | C13 | C48 | H482 | 126.1° | 77.5° |
| H13 | C13 | C14 | C15 | 51.4° | 56.4° |
| H13 | C13 | C14 | N23 | 127.9° | 122.0° |
| H13 | C13 | C12 | C11 | 116.5° | 121.1° |
| H13 | C13 | C12 | C46 | 122.0° | 2.6° |
| H13 | C13 | C12 | C47 | 1.7° | 120.4° |
| C49 | C48 | H481 | H482 | 112.5° | 120.0° |
| C48 | C49 | C50 | H491 | 125.2° | 119.9° |
| C48 | C49 | C50 | H492 | 125.3° | 120.0° |
| C48 | C49 | H491 | H492 | 117.3° | 120.0° |
| C48 | C49 | C50 | O51 | 110.9° | 0.0° |
| C48 | C49 | C50 | O52 | 67.8° | 180.0° |
| H481 | C48 | C49 | C50 | 36.5° | 63.7° |
| H481 | C48 | C49 | H491 | 161.8° | 176.3° |
| H481 | C48 | C49 | H492 | 88.7° | 56.3° |
| H482 | C48 | C49 | C50 | 72.9° | 56.3° |
| H482 | C48 | C49 | H491 | 52.4° | 63.7° |
| H482 | C48 | C49 | H492 | 161.9° | 176.3° |
| C50 | C49 | H491 | H492 | 117.3° | 120.0° |
| C49 | C50 | O51 | O52 | 178.6° | 180.0° |
| C49 | C50 | O52 | H52 | 179.9° | 180.0° |
| H491 | C49 | C50 | O51 | 14.4° | 120.0° |
| H491 | C49 | C50 | O52 | 167.0° | 60.0° |
| H492 | C49 | C50 | O51 | 123.9° | 120.0° |
| H492 | C49 | C50 | O52 | 57.5° | 60.0° |
| O51 | C50 | O52 | H52 | 1.4° | 0.0° |
| C15 | C14 | N23 | C11 | 179.4° | 175.0° |
| C14 | C15 | C16 | C64 | 178.7° | 179.9° |
| C14 | C15 | C16 | C17 | 179.6° | 154.0° |
| C14 | C15 | C16 | N24 | 0.9° | 25.8° |
| C14 | C15 | C64 | H641 | 180.0° | 6.3° |
| C14 | C15 | C64 | H642 | 54.7° | 126.3° |
| C14 | C15 | C64 | H643 | 54.7° | 113.8° |
| C14 | N23 | C11 | C10 | 178.0° | 179.5° |
| C14 | N23 | C11 | C12 | 1.0° | 1.3° |
| N23 | C14 | C15 | C16 | 2.2° | 1.9° |
| N23 | C14 | C15 | C64 | 179.0° | 177.9° |
| O45 | C43 | C42 | C41 | 161.7° | 180.0° |
| O45 | C43 | C42 | H421 | 73.0° | 60.0° |
| O45 | C43 | C42 | H422 | 36.4° | 60.0° |
| C42 | C43 | O45 | H45 | 2.5° | 180.0° |
| C43 | C42 | C41 | H421 | 125.2° | 120.0° |
| C43 | C42 | C41 | H422 | 125.3° | 120.1° |
| C43 | C42 | H421 | H422 | 115.6° | 120.0° |
| C43 | C42 | C41 | C8 | 173.9° | 180.0° |
| C43 | C42 | C41 | H411 | 48.6° | 60.0° |
| C43 | C42 | C41 | H412 | 60.9° | 60.0° |
| C10 | C9 | N22 | C8 | 178.7° | 177.1° |
| C9 | C10 | C11 | H10 | 180.0° | 179.6° |
| C9 | C10 | C11 | C12 | 179.2° | 172.7° |
| C9 | C10 | C11 | N23 | 0.4° | 5.2° |
| C10 | C9 | N22 | C6 | 173.7° | 166.5° |
| C10 | C9 | C8 | C41 | 76.0° | 73.6° |
| C10 | C9 | C8 | C7 | 162.5° | 168.0° |
| C10 | C9 | C8 | H8 | 40.7° | 49.6° |
| N22 | C9 | C10 | C11 | 2.0° | 4.1° |
| N22 | C9 | C10 | H10 | 177.9° | 176.4° |
| N22 | C9 | C8 | C41 | 102.7° | 109.2° |
| N22 | C9 | C8 | C7 | 18.8° | 9.2° |
| N22 | C9 | C8 | H8 | 140.6° | 127.6° |
| C9 | N22 | C6 | C7 | 7.6° | 7.0° |
| C9 | N22 | C6 | C5 | 173.9° | 175.4° |
| C8 | C9 | C10 | C11 | 179.5° | 172.6° |
| C8 | C9 | C10 | H10 | 0.6° | 7.0° |
| C9 | C8 | C41 | C42 | 172.1° | 66.5° |
| C8 | C9 | N22 | C6 | 7.6° | 10.5° |
| C9 | C8 | C7 | C36 | 144.1° | 123.5° |
| C9 | C8 | C7 | C37 | 93.0° | 113.4° |
| C9 | C8 | C41 | C7 | 114.2° | 113.5° |
| C9 | C8 | C41 | H8 | 123.7° | 123.3° |
| C9 | C8 | C7 | H8 | 123.5° | 118.4° |
| C9 | C8 | C41 | H411 | 62.6° | 53.4° |
| C9 | C8 | C41 | H412 | 46.9° | 173.4° |
| C9 | C8 | C7 | C6 | 21.9° | 5.1° |
| C10 | C11 | C12 | N23 | 178.9° | 178.2° |
| C10 | C11 | C12 | C46 | 50.3° | 64.4° |
| C10 | C11 | C12 | C47 | 67.8° | 58.7° |
| H10 | C10 | C11 | C12 | 0.8° | 6.8° |
| H10 | C10 | C11 | N23 | 179.7° | 175.2° |
| C11 | C12 | C46 | C47 | 119.6° | 123.1° |
| C11 | C12 | C46 | H461 | 64.2° | 61.4° |
| C11 | C12 | C46 | H462 | 61.1° | 178.5° |
| C11 | C12 | C46 | H463 | 170.6° | 58.5° |
| C11 | C12 | C47 | H471 | 71.4° | 56.8° |
| C11 | C12 | C47 | H472 | 163.4° | 63.2° |
| C11 | C12 | C47 | H473 | 53.9° | 176.8° |
| N23 | C11 | C12 | C46 | 128.6° | 117.4° |
| N23 | C11 | C12 | C47 | 113.2° | 119.6° |
| C12 | C46 | H461 | H462 | 125.3° | 120.0° |
| C12 | C46 | H461 | H463 | 125.2° | 119.9° |
| C12 | C46 | H462 | H463 | 114.3° | 119.9° |
| C46 | C12 | C47 | H471 | 49.3° | 66.3° |
| C46 | C12 | C47 | H472 | 76.0° | 173.7° |
| C46 | C12 | C47 | H473 | 174.6° | 53.7° |
| C47 | C12 | C46 | H461 | 55.4° | 61.6° |
| C47 | C12 | C46 | H462 | 179.3° | 58.4° |
| C47 | C12 | C46 | H463 | 69.8° | 178.4° |
| C12 | C47 | H471 | H472 | 125.3° | 120.0° |
| C12 | C47 | H471 | H473 | 125.3° | 120.0° |
| C12 | C47 | H472 | H473 | 118.3° | 120.0° |
| H461 | C46 | H462 | H463 | 114.2° | 120.1° |
| H471 | C47 | H472 | H473 | 118.3° | 120.0° |
| C60 | C18 | C19 | C17 | 142.3° | 117.8° |
| C60 | C18 | C19 | H18 | 105.0° | 124.4° |
| C60 | C18 | C17 | H18 | 99.4° | 124.3° |
| C18 | C60 | C61 | H601 | 125.3° | 120.0° |
| C18 | C60 | C61 | H602 | 125.3° | 120.0° |
| C18 | C60 | H601 | H602 | 113.7° | 120.0° |
| C18 | C60 | C61 | O63 | 140.8° | 169.5° |
| C18 | C60 | C61 | O62 | 41.3° | 10.4° |
| C60 | C18 | C19 | N24 | 164.5° | 145.6° |
| C60 | C18 | C19 | C1 | 65.8° | 97.1° |
| C60 | C18 | C19 | H19 | 42.1° | 25.8° |
| C60 | C18 | C17 | C16 | 155.3° | 146.6° |
| C60 | C18 | C17 | C54 | 44.8° | 28.2° |
| C60 | C18 | C17 | C55 | 69.3° | 94.9° |
| C19 | C18 | C17 | H18 | 126.0° | 117.7° |
| C19 | C18 | C60 | C61 | 175.1° | 176.8° |
| C19 | C18 | C60 | H601 | 59.6° | 63.2° |
| C19 | C18 | C60 | H602 | 49.9° | 56.9° |
| C18 | C19 | N24 | C1 | 131.4° | 118.3° |
| C18 | C19 | N24 | H19 | 120.4° | 119.2° |
| C18 | C19 | C1 | H19 | 117.7° | 122.6° |
| C19 | C18 | C17 | C16 | 20.8° | 28.6° |
| C18 | C19 | N24 | C16 | 18.4° | 16.9° |
| C19 | C18 | C17 | C54 | 89.7° | 89.7° |
| C19 | C18 | C17 | C55 | 156.2° | 147.2° |
| C18 | C19 | C1 | C2 | 69.1° | 111.0° |
| C18 | C19 | C1 | N21 | 166.9° | 131.6° |
| C18 | C19 | C1 | C20 | 57.2° | 10.9° |
| C17 | C18 | C60 | C61 | 53.2° | 72.2° |
| C17 | C18 | C60 | H601 | 72.1° | 47.8° |
| C17 | C18 | C60 | H602 | 178.5° | 167.9° |
| C17 | C18 | C19 | N24 | 22.2° | 27.8° |
| C17 | C18 | C19 | C1 | 152.0° | 145.0° |
| C17 | C18 | C19 | H19 | 100.2° | 92.0° |
| C18 | C17 | C16 | C15 | 169.9° | 158.9° |
| C18 | C17 | C16 | C54 | 115.3° | 118.4° |
| C18 | C17 | C16 | C55 | 126.6° | 118.7° |
| C18 | C17 | C16 | N24 | 10.6° | 21.0° |
| C18 | C17 | C54 | C55 | 118.8° | 123.3° |
| C18 | C17 | C54 | H541 | 179.9° | 175.1° |
| C18 | C17 | C54 | H542 | 54.8° | 55.1° |
| C18 | C17 | C54 | H543 | 54.7° | 64.9° |
| C18 | C17 | C55 | C56 | 123.3° | 55.9° |
| C18 | C17 | C55 | H551 | 111.5° | 175.8° |
| C18 | C17 | C55 | H552 | 2.0° | 64.1° |
| H18 | C18 | C60 | C61 | 51.4° | 52.3° |
| H18 | C18 | C60 | H601 | 176.7° | 172.3° |
| H18 | C18 | C60 | H602 | 73.9° | 67.7° |
| H18 | C18 | C19 | N24 | 90.5° | 90.0° |
| H18 | C18 | C19 | C1 | 39.2° | 27.3° |
| H18 | C18 | C19 | H19 | 147.1° | 150.2° |
| H18 | C18 | C17 | C16 | 105.3° | 89.1° |
| H18 | C18 | C17 | C54 | 144.3° | 152.5° |
| H18 | C18 | C17 | C55 | 30.1° | 29.4° |
| C61 | C60 | H601 | H602 | 113.8° | 120.0° |
| C60 | C61 | O63 | O62 | 177.7° | 180.0° |
| C60 | C61 | O63 | H63 | 180.0° | 180.0° |
| H601 | C60 | C61 | O63 | 15.6° | 49.6° |
| H601 | C60 | C61 | O62 | 166.6° | 130.4° |
| H602 | C60 | C61 | O63 | 93.9° | 70.5° |
| H602 | C60 | C61 | O62 | 83.9° | 109.5° |
| O62 | C61 | O63 | H63 | 2.3° | 0.0° |
| N24 | C19 | C1 | H19 | 120.1° | 122.7° |
| C19 | N24 | C16 | C15 | 175.1° | 177.2° |
| C19 | N24 | C16 | C17 | 4.5° | 2.7° |
| N24 | C19 | C1 | C2 | 168.8° | 134.3° |
| N24 | C19 | C1 | N21 | 44.8° | 16.9° |
| N24 | C19 | C1 | C20 | 64.9° | 103.8° |
| C1 | C19 | N24 | C16 | 149.8° | 135.2° |
| C19 | C1 | C2 | C25 | 88.5° | 143.2° |
| C19 | C1 | C2 | C26 | 19.8° | 20.0° |
| C19 | C1 | C2 | C3 | 127.1° | 98.3° |
| C19 | C1 | C2 | N21 | 125.9° | 119.7° |
| C19 | C1 | C2 | C20 | 129.0° | 122.1° |
| C19 | C1 | N21 | C20 | 114.8° | 120.9° |
| C19 | C1 | N21 | C4 | 139.7° | 113.4° |
| C19 | C1 | N21 | H21 | 95.1° | 66.6° |
| C19 | C1 | C20 | H201 | 180.0° | 57.2° |
| C19 | C1 | C20 | H202 | 54.8° | 62.7° |
| C19 | C1 | C20 | H203 | 54.7° | 177.2° |
| H19 | C19 | N24 | C16 | 102.0° | 102.3° |
| H19 | C19 | C1 | C2 | 48.6° | 11.6° |
| H19 | C19 | C1 | N21 | 75.4° | 105.8° |
| H19 | C19 | C1 | C20 | 174.9° | 133.5° |
| O58 | C57 | O59 | C56 | 178.8° | 179.9° |
| O58 | C57 | O59 | H59 | 179.9° | 0.1° |
| O58 | C57 | C56 | C55 | 4.5° | 0.1° |
| O58 | C57 | C56 | H561 | 120.8° | 120.1° |
| O58 | C57 | C56 | H562 | 129.7° | 120.0° |
| C15 | C16 | C17 | N24 | 179.5° | 179.9° |
| C15 | C16 | C17 | C54 | 74.7° | 82.8° |
| C15 | C16 | C17 | C55 | 43.4° | 40.2° |
| C16 | C15 | C64 | H641 | 1.0° | 173.6° |
| C16 | C15 | C64 | H642 | 124.3° | 53.6° |
| C16 | C15 | C64 | H643 | 126.3° | 66.4° |
| C64 | C15 | C16 | C17 | 0.9° | 26.1° |
| C64 | C15 | C16 | N24 | 179.7° | 154.1° |
| C15 | C64 | H641 | H642 | 125.3° | 120.0° |
| C15 | C64 | H641 | H643 | 125.2° | 120.0° |
| C15 | C64 | H642 | H643 | 117.5° | 120.0° |
| O59 | C57 | C56 | C55 | 174.3° | 180.0° |
| O59 | C57 | C56 | H561 | 60.5° | 60.0° |
| O59 | C57 | C56 | H562 | 49.0° | 59.9° |
| H59 | O59 | C57 | C56 | 1.2° | 180.0° |
| C16 | C17 | C54 | C55 | 132.3° | 123.1° |
| C16 | C17 | C54 | H541 | 71.1° | 61.4° |
| C16 | C17 | C54 | H542 | 54.1° | 58.5° |
| C16 | C17 | C54 | H543 | 163.6° | 178.5° |
| C16 | C17 | C55 | C56 | 0.6° | 57.9° |
| C16 | C17 | C55 | H551 | 125.8° | 62.0° |
| C16 | C17 | C55 | H552 | 124.7° | 177.9° |
| N24 | C16 | C17 | C54 | 104.7° | 97.4° |
| N24 | C16 | C17 | C55 | 137.1° | 139.7° |
| C17 | C54 | H541 | H542 | 125.2° | 119.9° |
| C17 | C54 | H541 | H543 | 125.3° | 120.1° |
| C17 | C54 | H542 | H543 | 117.6° | 120.1° |
| C54 | C17 | C55 | C56 | 118.0° | 179.1° |
| C54 | C17 | C55 | H551 | 7.3° | 61.0° |
| C54 | C17 | C55 | H552 | 116.8° | 59.0° |
| C55 | C17 | C54 | H541 | 61.2° | 61.7° |
| C55 | C17 | C54 | H542 | 173.6° | 178.4° |
| C55 | C17 | C54 | H543 | 64.1° | 58.4° |
| C17 | C55 | C56 | H551 | 125.2° | 120.0° |
| C17 | C55 | C56 | H552 | 125.2° | 120.1° |
| C17 | C55 | H551 | H552 | 112.1° | 120.1° |
| C17 | C55 | C56 | C57 | 105.6° | 174.1° |
| C17 | C55 | C56 | H561 | 129.1° | 66.0° |
| C17 | C55 | C56 | H562 | 19.6° | 54.0° |
| H541 | C54 | H542 | H543 | 117.7° | 120.0° |
| C56 | C55 | H551 | H552 | 112.2° | 119.9° |
| C55 | C56 | C57 | H561 | 125.3° | 120.0° |
| C55 | C56 | C57 | H562 | 125.2° | 120.1° |
| C55 | C56 | H561 | H562 | 115.3° | 120.0° |
| H551 | C55 | C56 | C57 | 19.6° | 54.1° |
| H551 | C55 | C56 | H561 | 105.7° | 174.1° |
| H551 | C55 | C56 | H562 | 144.8° | 66.0° |
| H552 | C55 | C56 | C57 | 129.1° | 65.9° |
| H552 | C55 | C56 | H561 | 3.9° | 54.1° |
| H552 | C55 | C56 | H562 | 105.6° | 174.0° |
| C57 | C56 | H561 | H562 | 115.3° | 120.0° |
| C41 | C42 | H421 | H422 | 115.7° | 120.0° |
| C42 | C41 | C8 | H411 | 125.3° | 120.0° |
| C42 | C41 | C8 | H412 | 125.3° | 120.0° |
| C42 | C41 | C8 | C7 | 73.7° | 180.0° |
| C42 | C41 | C8 | H8 | 48.4° | 56.8° |
| C42 | C41 | H411 | H412 | 115.3° | 120.0° |
| H421 | C42 | C41 | C8 | 60.9° | 60.0° |
| H421 | C42 | C41 | H411 | 173.8° | 180.0° |
| H421 | C42 | C41 | H412 | 64.4° | 60.0° |
| H422 | C42 | C41 | C8 | 48.6° | 59.9° |
| H422 | C42 | C41 | H411 | 76.7° | 60.0° |
| H422 | C42 | C41 | H412 | 173.9° | 179.9° |
| C2 | C25 | H251 | H252 | 125.2° | 120.0° |
| C2 | C25 | H251 | H253 | 125.3° | 119.9° |
| C2 | C25 | H252 | H253 | 119.6° | 120.0° |
| C25 | C2 | C26 | C27 | 55.8° | 51.4° |
| C25 | C2 | C26 | C3 | 123.4° | 123.2° |
| C25 | C2 | C26 | C1 | 129.6° | 123.3° |
| C25 | C2 | C26 | H261 | 178.9° | 68.6° |
| C25 | C2 | C26 | H262 | 69.5° | 171.4° |
| C25 | C2 | C3 | C30 | 29.6° | 26.3° |
| C25 | C2 | C3 | C1 | 149.9° | 118.4° |
| C25 | C2 | C3 | C4 | 151.7° | 92.1° |
| C25 | C2 | C3 | H31 | 84.3° | 149.5° |
| C25 | C2 | C1 | N21 | 145.6° | 97.1° |
| C25 | C2 | C1 | C20 | 40.5° | 21.1° |
| H251 | C25 | H252 | H253 | 119.7° | 120.0° |
| H251 | C25 | C2 | C26 | 180.0° | 55.4° |
| H251 | C25 | C2 | C3 | 62.0° | 67.7° |
| H251 | C25 | C2 | C1 | 80.1° | 178.7° |
| H252 | C25 | C2 | C26 | 54.7° | 175.4° |
| H252 | C25 | C2 | C3 | 172.8° | 52.3° |
| H252 | C25 | C2 | C1 | 45.2° | 61.2° |
| H253 | C25 | C2 | C26 | 54.7° | 64.5° |
| H253 | C25 | C2 | C3 | 63.3° | 172.4° |
| H253 | C25 | C2 | C1 | 154.7° | 58.8° |
| C27 | C26 | C2 | H261 | 125.3° | 120.0° |
| C27 | C26 | C2 | H262 | 125.3° | 120.0° |
| C27 | C26 | H261 | H262 | 112.2° | 120.0° |
| C26 | C27 | O28 | O29 | 179.8° | 180.0° |
| C26 | C27 | O29 | H29 | 180.0° | 180.0° |
| C27 | C26 | C2 | C3 | 67.6° | 71.9° |
| C27 | C26 | C2 | C1 | 174.6° | 174.7° |
| C2 | C26 | H261 | H262 | 112.2° | 120.0° |
| C2 | C26 | C27 | O28 | 95.9° | 1.7° |
| C2 | C26 | C27 | O29 | 84.3° | 178.3° |
| C26 | C2 | C3 | C30 | 146.7° | 96.8° |
| C26 | C2 | C3 | C1 | 93.0° | 118.4° |
| C26 | C2 | C3 | C4 | 91.2° | 144.7° |
| C26 | C2 | C3 | H31 | 32.8° | 26.3° |
| C26 | C2 | C1 | N21 | 106.2° | 139.7° |
| C26 | C2 | C1 | C20 | 148.8° | 102.1° |
| H261 | C26 | C27 | O28 | 29.4° | 121.8° |
| H261 | C26 | C27 | O29 | 150.4° | 58.2° |
| H261 | C26 | C2 | C3 | 57.7° | 168.1° |
| H261 | C26 | C2 | C1 | 49.3° | 54.7° |
| H262 | C26 | C27 | O28 | 138.8° | 118.3° |
| H262 | C26 | C27 | O29 | 41.0° | 61.7° |
| H262 | C26 | C2 | C3 | 167.0° | 48.2° |
| H262 | C26 | C2 | C1 | 60.1° | 65.3° |
| O28 | C27 | O29 | H29 | 0.2° | 0.0° |
| C30 | C3 | C2 | C4 | 122.1° | 118.5° |
| C30 | C3 | C2 | H31 | 113.9° | 123.1° |
| C30 | C3 | C4 | H31 | 114.1° | 123.0° |
| C3 | C30 | C31 | H301 | 125.3° | 120.0° |
| C3 | C30 | C31 | H302 | 125.3° | 119.9° |
| C3 | C30 | H301 | H302 | 114.5° | 120.0° |
| C30 | C3 | C2 | C1 | 120.2° | 144.8° |
| C30 | C3 | C4 | N21 | 124.2° | 141.9° |
| C3 | C30 | C31 | C32 | 179.3° | 174.0° |
| C3 | C30 | C31 | H311 | 54.0° | 66.0° |
| C3 | C30 | C31 | H312 | 55.5° | 54.0° |
| C30 | C3 | C4 | C5 | 56.0° | 41.1° |
| C2 | C3 | C4 | H31 | 119.6° | 118.5° |
| C2 | C3 | C30 | C31 | 94.4° | 131.2° |
| C2 | C3 | C30 | H301 | 140.3° | 108.8° |
| C2 | C3 | C30 | H302 | 30.9° | 11.3° |
| C3 | C2 | C1 | N21 | 1.1° | 21.4° |
| C2 | C3 | C4 | N21 | 2.1° | 23.4° |
| C3 | C2 | C1 | C20 | 104.0° | 139.6° |
| C2 | C3 | C4 | C5 | 177.7° | 159.6° |
| C4 | C3 | C30 | C31 | 148.4° | 115.0° |
| C4 | C3 | C30 | H301 | 23.1° | 5.0° |
| C4 | C3 | C30 | H302 | 86.3° | 125.0° |
| C4 | C3 | C2 | C1 | 1.9° | 26.3° |
| C3 | C4 | N21 | C1 | 1.6° | 10.1° |
| C3 | C4 | N21 | C5 | 179.8° | 177.0° |
| C3 | C4 | N21 | H21 | 123.7° | 169.9° |
| C3 | C4 | C5 | C35 | 1.1° | 16.4° |
| C3 | C4 | C5 | C6 | 177.6° | 163.0° |
| H31 | C3 | C30 | C31 | 24.7° | 8.0° |
| H31 | C3 | C30 | H301 | 100.6° | 128.1° |
| H31 | C3 | C30 | H302 | 149.9° | 111.9° |
| H31 | C3 | C2 | C1 | 125.9° | 92.1° |
| H31 | C3 | C4 | N21 | 121.7° | 95.1° |
| H31 | C3 | C4 | C5 | 58.1° | 81.9° |
| C31 | C30 | H301 | H302 | 114.6° | 120.0° |
| C30 | C31 | C32 | H311 | 125.2° | 120.1° |
| C30 | C31 | C32 | H312 | 125.2° | 120.0° |
| C30 | C31 | H311 | H312 | 115.8° | 120.0° |
| C30 | C31 | C32 | O34 | 116.1° | 180.0° |
| C30 | C31 | C32 | O33 | 63.2° | 0.0° |
| H301 | C30 | C31 | C32 | 55.4° | 53.9° |
| H301 | C30 | C31 | H311 | 179.3° | 174.0° |
| H301 | C30 | C31 | H312 | 69.8° | 66.0° |
| H302 | C30 | C31 | C32 | 54.0° | 66.1° |
| H302 | C30 | C31 | H311 | 71.3° | 54.0° |
| H302 | C30 | C31 | H312 | 179.3° | 173.9° |
| C2 | C1 | N21 | C20 | 105.2° | 118.1° |
| C2 | C1 | N21 | C4 | 0.3° | 7.7° |
| C2 | C1 | N21 | H21 | 125.0° | 172.4° |
| C2 | C1 | C20 | H201 | 38.7° | 179.4° |
| C2 | C1 | C20 | H202 | 163.9° | 60.6° |
| C2 | C1 | C20 | H203 | 86.6° | 59.5° |
| H641 | C64 | H642 | H643 | 117.6° | 120.0° |
| C1 | N21 | C4 | H21 | 125.3° | 180.0° |
| N21 | C1 | C20 | H201 | 66.7° | 63.6° |
| N21 | C1 | C20 | H202 | 58.5° | 176.4° |
| N21 | C1 | C20 | H203 | 168.0° | 56.4° |
| C1 | N21 | C4 | C5 | 178.2° | 172.9° |
| C4 | N21 | C1 | C20 | 105.5° | 125.7° |
| N21 | C4 | C5 | C35 | 178.7° | 167.0° |
| N21 | C4 | C5 | C6 | 2.7° | 13.6° |
| H21 | N21 | C1 | C20 | 19.7° | 54.3° |
| H21 | N21 | C4 | C5 | 56.5° | 7.1° |
| N22 | C6 | C7 | C36 | 142.7° | 118.1° |
| N22 | C6 | C7 | C37 | 94.9° | 118.9° |
| N22 | C6 | C7 | C8 | 18.6° | 0.4° |
| N22 | C6 | C7 | C5 | 178.1° | 177.7° |
| N22 | C6 | C5 | C4 | 3.2° | 11.0° |
| N22 | C6 | C5 | C35 | 178.2° | 168.4° |
| C1 | C20 | H201 | H202 | 125.2° | 120.0° |
| C1 | C20 | H201 | H203 | 125.3° | 120.0° |
| C1 | C20 | H202 | H203 | 118.2° | 120.1° |
| H201 | C20 | H202 | H203 | 118.2° | 119.9° |
| C32 | C31 | H311 | H312 | 115.9° | 120.0° |
| C31 | C32 | O34 | O33 | 179.3° | 180.0° |
| C31 | C32 | O34 | H34 | 179.9° | 179.9° |
| H311 | C31 | C32 | O34 | 118.7° | 59.9° |
| H311 | C31 | C32 | O33 | 62.0° | 120.1° |
| H312 | C31 | C32 | O34 | 9.2° | 60.0° |
| H312 | C31 | C32 | O33 | 171.6° | 120.0° |
| C7 | C36 | H361 | H362 | 125.2° | 119.9° |
| C7 | C36 | H361 | H363 | 125.2° | 120.0° |
| C7 | C36 | H362 | H363 | 117.7° | 120.0° |
| C36 | C7 | C37 | C38 | 57.9° | 175.0° |
| C36 | C7 | C37 | C8 | 125.4° | 123.1° |
| C36 | C7 | C37 | C6 | 123.2° | 123.0° |
| C36 | C7 | C37 | H371 | 176.9° | 65.0° |
| C36 | C7 | C37 | H372 | 67.4° | 55.1° |
| C36 | C7 | C8 | C41 | 24.4° | 5.1° |
| C36 | C7 | C8 | C6 | 122.2° | 118.5° |
| C36 | C7 | C8 | H8 | 92.4° | 118.0° |
| C36 | C7 | C6 | C5 | 39.2° | 59.6° |
| H361 | C36 | H362 | H363 | 117.8° | 120.0° |
| H361 | C36 | C7 | C37 | 180.0° | 61.6° |
| H361 | C36 | C7 | C8 | 59.1° | 175.3° |
| H361 | C36 | C7 | C6 | 58.6° | 61.5° |
| H362 | C36 | C7 | C37 | 54.7° | 58.4° |
| H362 | C36 | C7 | C8 | 175.6° | 64.7° |
| H362 | C36 | C7 | C6 | 66.7° | 178.6° |
| H363 | C36 | C7 | C37 | 54.8° | 178.3° |
| H363 | C36 | C7 | C8 | 66.1° | 55.3° |
| H363 | C36 | C7 | C6 | 176.2° | 58.6° |
| C38 | C37 | C7 | H371 | 125.2° | 120.0° |
| C38 | C37 | C7 | H372 | 125.3° | 119.9° |
| C38 | C37 | H371 | H372 | 114.7° | 120.0° |
| C37 | C38 | O39 | O40 | 178.2° | 180.0° |
| C37 | C38 | O40 | H40 | 180.0° | 180.0° |
| C38 | C37 | C7 | C8 | 67.5° | 61.9° |
| C38 | C37 | C7 | C6 | 178.9° | 52.0° |
| C7 | C37 | H371 | H372 | 114.7° | 120.0° |
| C7 | C37 | C38 | O39 | 100.1° | 5.4° |
| C7 | C37 | C38 | O40 | 78.1° | 174.6° |
| C37 | C7 | C8 | C41 | 147.3° | 128.1° |
| C37 | C7 | C8 | C6 | 114.9° | 118.5° |
| C37 | C7 | C8 | H8 | 30.5° | 5.0° |
| C37 | C7 | C6 | C5 | 83.2° | 63.5° |
| H371 | C37 | C38 | O39 | 134.7° | 114.6° |
| H371 | C37 | C38 | O40 | 47.1° | 65.4° |
| H371 | C37 | C7 | C8 | 57.7° | 58.1° |
| H371 | C37 | C7 | C6 | 53.7° | 172.0° |
| H372 | C37 | C38 | O39 | 25.1° | 125.4° |
| H372 | C37 | C38 | O40 | 156.6° | 54.6° |
| H372 | C37 | C7 | C8 | 167.2° | 178.1° |
| H372 | C37 | C7 | C6 | 55.8° | 68.0° |
| O39 | C38 | O40 | H40 | 1.8° | 0.0° |
| C41 | C8 | C7 | H8 | 116.8° | 123.1° |
| C8 | C41 | H411 | H412 | 115.3° | 120.0° |
| C41 | C8 | C7 | C6 | 97.8° | 113.4° |
| C7 | C8 | C41 | H411 | 51.6° | 60.0° |
| C7 | C8 | C41 | H412 | 161.1° | 60.0° |
| C8 | C7 | C6 | C5 | 163.3° | 178.0° |
| H8 | C8 | C41 | H411 | 173.7° | 176.7° |
| H8 | C8 | C41 | H412 | 76.9° | 63.2° |
| H8 | C8 | C7 | C6 | 145.4° | 123.5° |
| C7 | C6 | C5 | C4 | 178.9° | 166.3° |
| C7 | C6 | C5 | C35 | 0.3° | 14.3° |
| O33 | C32 | O34 | H34 | 0.7° | 0.1° |
| C4 | C5 | C35 | C6 | 178.8° | 179.4° |
| C4 | C5 | C35 | H351 | 180.0° | 175.3° |
| C4 | C5 | C35 | H352 | 54.8° | 64.7° |
| C4 | C5 | C35 | H353 | 54.7° | 55.2° |
| C5 | C35 | H351 | H352 | 125.2° | 120.0° |
| C5 | C35 | H351 | H353 | 125.3° | 120.0° |
| C5 | C35 | H352 | H353 | 117.0° | 119.9° |
| C6 | C5 | C35 | H351 | 1.2° | 4.1° |
| C6 | C5 | C35 | H352 | 124.1° | 116.0° |
| C6 | C5 | C35 | H353 | 126.4° | 124.1° |
| H351 | C35 | H352 | H353 | 117.1° | 120.1° |
