SQX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O6 | C5 | doub | 1.21Å | 1.23Å | |
| C5 | O1 | sing | 1.34Å | 1.45Å | |
| C5 | C4 | sing | 1.51Å | 1.50Å | |
| O1 | C2 | sing | 1.46Å | 1.43Å | |
| C2 | C3 | sing | 1.55Å | 1.53Å | |
| C2 | C8 | sing | 1.51Å | 1.50Å | |
| C3 | C4 | sing | 1.54Å | 1.53Å | |
| C4 | C7 | sing | 1.53Å | 1.52Å | |
| C8 | C13 | doub | 1.29Å | 1.34Å | |
| C8 | C9 | sing | 1.49Å | 1.51Å | |
| C13 | C14 | sing | 1.51Å | 1.50Å | |
| C13 | C12 | sing | 1.50Å | 1.52Å | |
| C12 | C27 | sing | 1.53Å | 1.54Å | |
| C12 | C15 | sing | 1.48Å | 1.52Å | |
| C27 | C10 | sing | 1.53Å | 1.52Å | |
| C27 | C32 | sing | 1.51Å | 1.53Å | |
| C27 | C28 | sing | 1.51Å | 1.54Å | |
| C10 | C9 | sing | 1.51Å | 1.51Å | |
| C15 | C16 | doub | 1.29Å | 1.35Å | |
| C16 | C19 | sing | 1.50Å | 1.51Å | |
| C16 | C17 | sing | 1.53Å | 1.51Å | |
| C17 | O20 | sing | 1.43Å | 1.44Å | |
| C17 | C18 | sing | 1.53Å | 1.52Å | |
| C18 | C21 | sing | 1.52Å | 1.52Å | |
| C21 | O48 | sing | 1.43Å | 1.42Å | |
| C21 | C81 | sing | 1.54Å | 1.53Å | |
| O48 | C23 | sing | 1.43Å | 1.43Å | |
| C81 | C80 | sing | 1.54Å | 1.52Å | |
| C80 | C23 | sing | 1.53Å | 1.52Å | |
| C23 | O44 | sing | 1.43Å | 1.42Å | |
| C23 | C55 | sing | 1.53Å | 1.53Å | |
| O44 | C43 | sing | 1.43Å | 1.43Å | |
| C55 | C42 | sing | 1.55Å | 1.53Å | |
| C42 | C43 | sing | 1.53Å | 1.54Å | |
| C43 | C51 | sing | 1.53Å | 1.54Å | |
| C43 | O47 | sing | 1.43Å | 1.44Å | |
| C51 | C53 | sing | 1.53Å | 1.53Å | |
| C51 | O52 | sing | 1.43Å | 1.43Å | |
| C51 | C50 | sing | 1.53Å | 1.53Å | |
| C50 | C49 | sing | 1.53Å | 1.53Å | |
| C49 | C48 | sing | 1.53Å | 1.53Å | |
| O47 | C48 | sing | 1.43Å | 1.43Å | |
| C48 | C37 | sing | 1.53Å | 1.54Å | |
| C37 | C36 | sing | 1.50Å | 1.52Å | |
| C36 | C38 | doub | 1.31Å | 1.33Å | |
| C36 | C35 | sing | 1.51Å | 1.52Å | |
| C35 | C34 | sing | 1.53Å | 1.52Å | |
| C34 | C33 | sing | 1.53Å | 1.52Å | |
| C33 | C32 | sing | 1.51Å | 1.52Å | |
| C32 | N31 | doub | 1.27Å | 1.27Å | |
| N31 | C30 | sing | 1.45Å | 1.46Å | |
| C30 | C29 | sing | 1.52Å | 1.53Å | |
| C29 | C6 | sing | 1.53Å | 1.52Å | |
| C29 | C46 | sing | 1.52Å | 1.52Å | |
| C46 | C22 | sing | 1.52Å | 1.52Å | |
| C46 | C28 | sing | 1.50Å | 1.52Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H31C | sing | 1.09Å | 1.10Å | |
| C3 | H32C | sing | 1.09Å | 1.10Å | |
| C7 | H71C | sing | 1.09Å | 1.10Å | |
| C7 | H72C | sing | 1.09Å | 1.10Å | |
| C7 | H73C | sing | 1.09Å | 1.10Å | |
| C9 | H91C | sing | 1.10Å | 1.10Å | |
| C9 | H92C | sing | 1.08Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H143 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.13Å | 1.10Å | |
| C15 | H15 | sing | 1.13Å | 1.08Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C10 | H102 | sing | 1.10Å | 1.10Å | |
| C28 | H281 | sing | 1.11Å | 1.10Å | |
| C28 | H282 | sing | 1.11Å | 1.10Å | |
| C19 | H191 | sing | 1.09Å | 1.10Å | |
| C19 | H192 | sing | 1.09Å | 1.10Å | |
| C19 | H193 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| O20 | H20 | sing | 0.97Å | 0.95Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C81 | H811 | sing | 1.09Å | 1.10Å | |
| C81 | H812 | sing | 1.09Å | 1.10Å | |
| C80 | H801 | sing | 1.09Å | 1.10Å | |
| C80 | H802 | sing | 1.09Å | 1.10Å | |
| C55 | H551 | sing | 1.09Å | 1.10Å | |
| C55 | H552 | sing | 1.09Å | 1.10Å | |
| C42 | H421 | sing | 1.09Å | 1.10Å | |
| C42 | H422 | sing | 1.09Å | 1.10Å | |
| C53 | H531 | sing | 1.09Å | 1.10Å | |
| C53 | H532 | sing | 1.09Å | 1.10Å | |
| C53 | H533 | sing | 1.09Å | 1.10Å | |
| O52 | H52 | sing | 0.97Å | 0.95Å | |
| C50 | H501 | sing | 1.09Å | 1.10Å | |
| C50 | H502 | sing | 1.09Å | 1.10Å | |
| C49 | H491 | sing | 1.09Å | 1.10Å | |
| C49 | H492 | sing | 1.09Å | 1.10Å | |
| C48 | H48 | sing | 1.09Å | 1.10Å | |
| C37 | H371 | sing | 1.09Å | 1.10Å | |
| C37 | H372 | sing | 1.09Å | 1.10Å | |
| C38 | H381 | sing | 1.08Å | 1.08Å | |
| C38 | H382 | sing | 1.08Å | 1.08Å | |
| C35 | H351 | sing | 1.09Å | 1.10Å | |
| C35 | H352 | sing | 1.09Å | 1.10Å | |
| C34 | H341 | sing | 1.09Å | 1.10Å | |
| C34 | H342 | sing | 1.09Å | 1.10Å | |
| C33 | H331 | sing | 1.10Å | 1.10Å | |
| C33 | H332 | sing | 1.07Å | 1.10Å | |
| C30 | H301 | sing | 1.11Å | 1.10Å | |
| C30 | H302 | sing | 1.08Å | 1.10Å | |
| C29 | H29 | sing | 1.10Å | 1.10Å | |
| C6 | H61C | sing | 1.09Å | 1.10Å | |
| C6 | H62C | sing | 1.09Å | 1.10Å | |
| C6 | H63C | sing | 1.09Å | 1.10Å | |
| C46 | H46 | sing | 1.13Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C22 | H223 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O6 | C5 | O1 | 121.9° | 125.1° |
| O6 | C5 | C4 | 125.2° | 125.1° |
| O1 | C5 | C4 | 112.8° | 109.8° |
| C5 | O1 | C2 | 106.7° | 109.9° |
| C5 | C4 | C3 | 101.3° | 104.8° |
| C5 | C4 | C7 | 112.6° | 110.4° |
| C5 | C4 | H4 | 115.3° | 110.4° |
| O1 | C2 | C3 | 107.9° | 104.4° |
| O1 | C2 | C8 | 106.0° | 110.5° |
| O1 | C2 | H2 | 114.4° | 110.5° |
| C3 | C2 | C8 | 114.1° | 110.4° |
| C2 | C3 | C4 | 106.0° | 102.1° |
| C3 | C2 | H2 | 106.4° | 110.5° |
| C2 | C3 | H31C | 110.6° | 110.9° |
| C2 | C3 | H32C | 111.4° | 110.8° |
| C2 | C8 | C13 | 120.3° | 118.2° |
| C2 | C8 | C9 | 117.0° | 118.0° |
| C8 | C2 | H2 | 108.2° | 110.5° |
| C3 | C4 | C7 | 116.0° | 110.2° |
| C3 | C4 | H4 | 111.9° | 110.5° |
| C4 | C3 | H31C | 110.6° | 111.2° |
| C4 | C3 | H32C | 111.4° | 110.7° |
| C7 | C4 | H4 | 100.4° | 110.4° |
| C4 | C7 | H71C | 109.5° | 109.5° |
| C4 | C7 | H72C | 109.5° | 109.5° |
| C4 | C7 | H73C | 109.5° | 109.5° |
| C13 | C8 | C9 | 122.6° | 123.8° |
| C8 | C13 | C14 | 118.2° | 118.1° |
| C8 | C13 | C12 | 123.2° | 122.4° |
| C8 | C9 | C10 | 110.4° | 113.4° |
| C8 | C9 | H91C | 109.2° | 107.5° |
| C8 | C9 | H92C | 109.0° | 109.2° |
| C14 | C13 | C12 | 118.6° | 119.5° |
| C13 | C14 | H141 | 109.5° | 109.5° |
| C13 | C14 | H142 | 109.5° | 109.5° |
| C13 | C14 | H143 | 109.5° | 109.5° |
| C13 | C12 | C27 | 112.4° | 113.0° |
| C13 | C12 | C15 | 108.3° | 112.0° |
| C13 | C12 | H12 | 109.1° | 102.9° |
| C27 | C12 | C15 | 111.8° | 118.2° |
| C12 | C27 | C10 | 106.5° | 106.5° |
| C12 | C27 | C32 | 112.2° | 108.8° |
| C12 | C27 | C28 | 111.3° | 110.3° |
| C27 | C12 | H12 | 105.4° | 103.4° |
| C12 | C15 | C16 | 127.6° | 136.1° |
| C15 | C12 | H12 | 109.8° | 105.3° |
| C12 | C15 | H15 | 116.2° | 113.9° |
| C10 | C27 | C32 | 103.5° | 107.1° |
| C10 | C27 | C28 | 109.4° | 112.6° |
| C27 | C10 | C9 | 113.1° | 114.0° |
| C27 | C10 | H101 | 108.3° | 110.9° |
| C27 | C10 | H102 | 107.4° | 107.6° |
| C32 | C27 | C28 | 113.3° | 111.3° |
| C27 | C32 | C33 | 122.2° | 122.3° |
| C27 | C32 | N31 | 121.0° | 123.1° |
| C27 | C28 | C46 | 114.4° | 121.1° |
| C27 | C28 | H281 | 107.8° | 107.8° |
| C27 | C28 | H282 | 106.7° | 107.0° |
| C10 | C9 | H91C | 109.2° | 108.0° |
| C10 | C9 | H92C | 109.0° | 111.6° |
| C9 | C10 | H101 | 108.3° | 109.6° |
| C9 | C10 | H102 | 107.5° | 108.1° |
| C15 | C16 | C19 | 123.0° | 127.3° |
| C15 | C16 | C17 | 116.5° | 115.9° |
| C16 | C15 | H15 | 116.2° | 109.8° |
| C19 | C16 | C17 | 120.6° | 116.8° |
| C16 | C19 | H191 | 109.5° | 109.5° |
| C16 | C19 | H192 | 109.5° | 109.5° |
| C16 | C19 | H193 | 109.5° | 109.4° |
| C16 | C17 | O20 | 111.3° | 108.9° |
| C16 | C17 | C18 | 109.9° | 109.0° |
| C16 | C17 | H17 | 108.0° | 109.0° |
| O20 | C17 | C18 | 109.6° | 109.6° |
| O20 | C17 | H17 | 108.3° | 109.9° |
| C17 | O20 | H20 | 109.5° | 114.1° |
| C17 | C18 | C21 | 113.1° | 111.4° |
| C18 | C17 | H17 | 109.7° | 110.5° |
| C17 | C18 | H181 | 108.3° | 109.2° |
| C17 | C18 | H182 | 107.5° | 109.3° |
| C18 | C21 | O48 | 107.4° | 111.7° |
| C18 | C21 | C81 | 112.9° | 109.9° |
| C21 | C18 | H181 | 108.3° | 109.2° |
| C21 | C18 | H182 | 107.4° | 109.0° |
| C18 | C21 | H21 | 107.7° | 109.9° |
| O48 | C21 | C81 | 106.6° | 106.9° |
| C21 | O48 | C23 | 111.5° | 109.9° |
| O48 | C21 | H21 | 113.8° | 109.5° |
| C21 | C81 | C80 | 105.6° | 103.7° |
| C81 | C21 | H21 | 108.5° | 108.9° |
| C21 | C81 | H811 | 110.8° | 110.6° |
| C21 | C81 | H812 | 111.6° | 110.5° |
| O48 | C23 | C80 | 107.8° | 108.5° |
| O48 | C23 | O44 | 109.6° | 110.1° |
| O48 | C23 | C55 | 109.7° | 110.4° |
| C81 | C80 | C23 | 104.4° | 104.8° |
| C80 | C81 | H811 | 110.8° | 110.5° |
| C80 | C81 | H812 | 111.6° | 110.6° |
| C81 | C80 | H801 | 111.2° | 110.4° |
| C81 | C80 | H802 | 112.3° | 110.4° |
| C80 | C23 | O44 | 109.4° | 110.1° |
| C80 | C23 | C55 | 116.3° | 110.1° |
| C23 | C80 | H801 | 111.2° | 110.3° |
| C23 | C80 | H802 | 112.3° | 110.5° |
| O44 | C23 | C55 | 104.0° | 107.7° |
| C23 | O44 | C43 | 111.9° | 108.0° |
| C23 | C55 | C42 | 104.4° | 104.6° |
| C23 | C55 | H551 | 111.2° | 110.6° |
| C23 | C55 | H552 | 112.3° | 110.7° |
| O44 | C43 | C42 | 103.2° | 106.6° |
| O44 | C43 | C51 | 109.0° | 109.8° |
| O44 | C43 | O47 | 108.7° | 109.6° |
| C55 | C42 | C43 | 106.7° | 104.3° |
| C42 | C55 | H551 | 111.2° | 110.2° |
| C42 | C55 | H552 | 112.3° | 110.3° |
| C55 | C42 | H421 | 110.4° | 110.1° |
| C55 | C42 | H422 | 111.0° | 110.2° |
| C42 | C43 | C51 | 115.5° | 111.0° |
| C42 | C43 | O47 | 109.7° | 109.9° |
| C43 | C42 | H421 | 110.4° | 111.0° |
| C43 | C42 | H422 | 111.0° | 110.5° |
| C51 | C43 | O47 | 110.3° | 110.0° |
| C43 | C51 | C53 | 113.5° | 110.0° |
| C43 | C51 | O52 | 107.9° | 109.4° |
| C43 | C51 | C50 | 108.0° | 109.2° |
| C43 | O47 | C48 | 114.5° | 114.0° |
| C53 | C51 | O52 | 108.5° | 109.3° |
| C53 | C51 | C50 | 109.8° | 109.8° |
| C51 | C53 | H531 | 109.5° | 109.5° |
| C51 | C53 | H532 | 109.5° | 109.5° |
| C51 | C53 | H533 | 109.5° | 109.4° |
| O52 | C51 | C50 | 109.1° | 109.2° |
| C51 | O52 | H52 | 109.5° | 114.0° |
| C51 | C50 | C49 | 113.9° | 110.7° |
| C51 | C50 | H501 | 108.0° | 109.3° |
| C51 | C50 | H502 | 107.0° | 109.3° |
| C50 | C49 | C48 | 113.9° | 110.8° |
| C49 | C50 | H501 | 108.0° | 109.3° |
| C49 | C50 | H502 | 107.0° | 109.4° |
| C50 | C49 | H491 | 108.0° | 108.8° |
| C50 | C49 | H492 | 107.0° | 110.1° |
| C49 | C48 | O47 | 108.4° | 109.5° |
| C49 | C48 | C37 | 112.1° | 109.2° |
| C48 | C49 | H491 | 108.0° | 109.1° |
| C48 | C49 | H492 | 107.0° | 109.6° |
| C49 | C48 | H48 | 108.3° | 110.0° |
| O47 | C48 | C37 | 108.9° | 108.4° |
| O47 | C48 | H48 | 111.4° | 109.6° |
| C48 | C37 | C36 | 113.4° | 110.7° |
| C37 | C48 | H48 | 107.7° | 110.0° |
| C48 | C37 | H371 | 108.2° | 109.4° |
| C48 | C37 | H372 | 107.3° | 108.7° |
| C37 | C36 | C38 | 119.5° | 120.6° |
| C37 | C36 | C35 | 119.5° | 120.3° |
| C36 | C37 | H371 | 108.2° | 109.6° |
| C36 | C37 | H372 | 107.3° | 109.4° |
| C38 | C36 | C35 | 121.1° | 119.2° |
| C36 | C38 | H381 | 108.2° | 119.9° |
| C36 | C38 | H382 | 125.9° | 120.0° |
| C36 | C35 | C34 | 113.8° | 110.1° |
| C36 | C35 | H351 | 108.0° | 109.4° |
| C36 | C35 | H352 | 107.0° | 108.8° |
| C35 | C34 | C33 | 110.2° | 110.0° |
| C34 | C35 | H351 | 108.1° | 109.8° |
| C34 | C35 | H352 | 107.1° | 109.3° |
| C35 | C34 | H341 | 109.3° | 109.4° |
| C35 | C34 | H342 | 109.1° | 110.1° |
| C34 | C33 | C32 | 115.6° | 109.0° |
| C33 | C34 | H341 | 109.2° | 109.2° |
| C33 | C34 | H342 | 109.1° | 109.1° |
| C34 | C33 | H331 | 107.5° | 108.2° |
| C34 | C33 | H332 | 106.1° | 110.6° |
| C33 | C32 | N31 | 116.8° | 114.5° |
| C32 | C33 | H331 | 107.5° | 108.0° |
| C32 | C33 | H332 | 106.0° | 112.2° |
| C32 | N31 | C30 | 131.9° | 128.0° |
| N31 | C30 | C29 | 109.0° | 110.5° |
| N31 | C30 | H301 | 109.6° | 108.4° |
| N31 | C30 | H302 | 109.8° | 112.1° |
| C30 | C29 | C6 | 110.3° | 110.1° |
| C30 | C29 | C46 | 111.8° | 112.6° |
| C29 | C30 | H301 | 109.7° | 107.9° |
| C29 | C30 | H302 | 109.7° | 111.2° |
| C30 | C29 | H29 | 107.8° | 107.7° |
| C6 | C29 | C46 | 110.9° | 110.7° |
| C6 | C29 | H29 | 108.8° | 107.3° |
| C29 | C6 | H61C | 109.5° | 109.5° |
| C29 | C6 | H62C | 109.5° | 109.4° |
| C29 | C6 | H63C | 109.4° | 109.5° |
| C29 | C46 | C22 | 112.5° | 110.9° |
| C29 | C46 | C28 | 111.1° | 116.9° |
| C46 | C29 | H29 | 107.1° | 108.2° |
| C29 | C46 | H46 | 106.8° | 104.2° |
| C22 | C46 | C28 | 111.0° | 114.4° |
| C22 | C46 | H46 | 106.8° | 103.9° |
| C46 | C22 | H221 | 109.5° | 109.5° |
| C46 | C22 | H222 | 109.4° | 109.4° |
| C46 | C22 | H223 | 109.4° | 109.5° |
| C46 | C28 | H281 | 107.8° | 108.0° |
| C46 | C28 | H282 | 106.7° | 107.2° |
| C28 | C46 | H46 | 108.4° | 105.0° |
| H31C | C3 | H32C | 106.9° | 110.9° |
| H71C | C7 | H72C | 109.4° | 109.4° |
| H71C | C7 | H73C | 109.5° | 109.4° |
| H72C | C7 | H73C | 109.5° | 109.5° |
| H91C | C9 | H92C | 110.2° | 106.9° |
| H141 | C14 | H142 | 109.5° | 109.4° |
| H141 | C14 | H143 | 109.4° | 109.5° |
| H142 | C14 | H143 | 109.5° | 109.4° |
| H101 | C10 | H102 | 112.3° | 106.2° |
| H281 | C28 | H282 | 113.5° | 104.6° |
| H191 | C19 | H192 | 109.5° | 109.5° |
| H191 | C19 | H193 | 109.4° | 109.5° |
| H192 | C19 | H193 | 109.5° | 109.5° |
| H181 | C18 | H182 | 112.3° | 108.6° |
| H811 | C81 | H812 | 106.5° | 110.7° |
| H801 | C80 | H802 | 105.6° | 110.4° |
| H551 | C55 | H552 | 105.6° | 110.3° |
| H421 | C42 | H422 | 107.3° | 110.5° |
| H531 | C53 | H532 | 109.4° | 109.5° |
| H531 | C53 | H533 | 109.4° | 109.4° |
| H532 | C53 | H533 | 109.5° | 109.5° |
| H501 | C50 | H502 | 113.0° | 108.8° |
| H491 | C49 | H492 | 113.0° | 108.4° |
| H371 | C37 | H372 | 112.6° | 109.0° |
| H381 | C38 | H382 | 125.9° | 120.1° |
| H351 | C35 | H352 | 113.0° | 109.3° |
| H341 | C34 | H342 | 110.0° | 109.0° |
| H331 | C33 | H332 | 114.4° | 108.8° |
| H301 | C30 | H302 | 109.1° | 106.5° |
| H61C | C6 | H62C | 109.4° | 109.5° |
| H61C | C6 | H63C | 109.5° | 109.5° |
| H62C | C6 | H63C | 109.5° | 109.5° |
| H221 | C22 | H222 | 109.5° | 109.5° |
| H221 | C22 | H223 | 109.5° | 109.5° |
| H222 | C22 | H223 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O6 | C5 | O1 | C4 | 179.2° | 179.8° |
| O6 | C5 | O1 | C2 | 176.1° | 159.2° |
| O6 | C5 | C4 | C3 | 163.7° | 177.9° |
| O6 | C5 | C4 | C7 | 39.1° | 63.4° |
| O6 | C5 | C4 | H4 | 75.3° | 58.9° |
| C5 | O1 | C2 | C3 | 10.1° | 30.7° |
| C5 | O1 | C2 | C8 | 132.8° | 149.4° |
| O1 | C5 | C4 | C3 | 17.2° | 1.9° |
| O1 | C5 | C4 | C7 | 141.8° | 116.8° |
| O1 | C5 | C4 | H4 | 103.8° | 120.9° |
| C5 | O1 | C2 | H2 | 108.0° | 88.1° |
| C4 | C5 | O1 | C2 | 4.8° | 20.6° |
| C5 | C4 | C3 | C2 | 22.1° | 15.7° |
| C5 | C4 | C3 | C7 | 122.2° | 118.8° |
| C5 | C4 | C3 | H4 | 123.4° | 118.9° |
| C5 | C4 | C7 | H4 | 123.2° | 122.3° |
| C5 | C4 | C3 | H31C | 97.9° | 102.5° |
| C5 | C4 | C3 | H32C | 143.4° | 133.7° |
| C5 | C4 | C7 | H71C | 143.5° | 58.6° |
| C5 | C4 | C7 | H72C | 96.5° | 178.5° |
| C5 | C4 | C7 | H73C | 23.5° | 61.4° |
| O1 | C2 | C3 | C8 | 117.5° | 118.8° |
| O1 | C2 | C3 | H2 | 123.2° | 118.7° |
| O1 | C2 | C8 | H2 | 123.2° | 122.5° |
| O1 | C2 | C3 | C4 | 21.0° | 27.1° |
| O1 | C2 | C8 | C13 | 112.1° | 149.8° |
| O1 | C2 | C8 | C9 | 65.5° | 31.4° |
| O1 | C2 | C3 | H31C | 99.0° | 91.3° |
| O1 | C2 | C3 | H32C | 142.3° | 145.0° |
| C3 | C2 | C8 | H2 | 118.2° | 122.5° |
| C2 | C3 | C4 | H31C | 120.0° | 118.3° |
| C2 | C3 | C4 | H32C | 121.3° | 118.0° |
| C2 | C3 | C4 | C7 | 144.3° | 134.5° |
| C3 | C2 | C8 | C13 | 129.3° | 95.2° |
| C3 | C2 | C8 | C9 | 53.1° | 83.6° |
| C2 | C3 | C4 | H4 | 101.3° | 103.2° |
| C2 | C3 | H31C | H32C | 121.4° | 123.6° |
| C8 | C2 | C3 | C4 | 138.5° | 145.9° |
| C2 | C8 | C13 | C9 | 177.4° | 178.7° |
| C2 | C8 | C13 | C14 | 3.5° | 1.3° |
| C2 | C8 | C13 | C12 | 177.4° | 179.2° |
| C2 | C8 | C9 | C10 | 167.0° | 175.1° |
| C8 | C2 | C3 | H31C | 18.5° | 27.4° |
| C8 | C2 | C3 | H32C | 100.2° | 96.2° |
| C2 | C8 | C9 | H91C | 47.0° | 55.8° |
| C2 | C8 | C9 | H92C | 73.3° | 59.8° |
| C3 | C4 | C7 | H4 | 120.7° | 122.4° |
| C4 | C3 | C2 | H2 | 102.2° | 91.6° |
| C4 | C3 | H31C | H32C | 121.4° | 123.6° |
| C3 | C4 | C7 | H71C | 27.5° | 56.8° |
| C3 | C4 | C7 | H72C | 147.4° | 63.2° |
| C3 | C4 | C7 | H73C | 92.5° | 176.8° |
| C7 | C4 | C3 | H31C | 24.3° | 16.3° |
| C7 | C4 | C3 | H32C | 94.3° | 107.5° |
| C4 | C7 | H71C | H72C | 120.0° | 120.0° |
| C4 | C7 | H71C | H73C | 120.0° | 120.1° |
| C4 | C7 | H72C | H73C | 120.0° | 120.1° |
| C8 | C13 | C14 | C12 | 179.1° | 179.5° |
| C8 | C13 | C12 | C27 | 16.7° | 23.5° |
| C8 | C13 | C12 | C15 | 140.8° | 160.0° |
| C13 | C8 | C9 | C10 | 15.4° | 3.6° |
| C13 | C8 | C2 | H2 | 11.1° | 27.3° |
| C13 | C8 | C9 | H91C | 135.4° | 122.9° |
| C13 | C8 | C9 | H92C | 104.2° | 121.5° |
| C8 | C13 | C14 | H141 | 65.0° | 5.5° |
| C8 | C13 | C14 | H142 | 55.0° | 125.5° |
| C8 | C13 | C14 | H143 | 175.1° | 114.5° |
| C8 | C13 | C12 | H12 | 99.8° | 87.4° |
| C9 | C8 | C13 | C14 | 179.1° | 177.4° |
| C9 | C8 | C13 | C12 | 0.0° | 2.1° |
| C8 | C9 | C10 | C27 | 49.3° | 35.1° |
| C8 | C9 | C10 | H91C | 120.0° | 119.0° |
| C8 | C9 | C10 | H92C | 119.6° | 123.9° |
| C9 | C8 | C2 | H2 | 171.3° | 153.9° |
| C8 | C9 | H91C | H92C | 119.6° | 117.1° |
| C8 | C9 | C10 | H101 | 169.3° | 160.1° |
| C8 | C9 | C10 | H102 | 69.2° | 84.5° |
| C14 | C13 | C12 | C27 | 164.2° | 157.1° |
| C14 | C13 | C12 | C15 | 40.1° | 20.6° |
| C13 | C14 | H141 | H142 | 120.0° | 120.0° |
| C13 | C14 | H141 | H143 | 120.0° | 120.1° |
| C13 | C14 | H142 | H143 | 120.0° | 120.0° |
| C14 | C13 | C12 | H12 | 79.3° | 92.1° |
| C13 | C12 | C27 | C15 | 122.1° | 133.6° |
| C13 | C12 | C27 | H12 | 118.7° | 110.6° |
| C13 | C12 | C15 | H12 | 119.0° | 111.1° |
| C13 | C12 | C27 | C10 | 46.5° | 50.8° |
| C13 | C12 | C27 | C32 | 159.1° | 166.0° |
| C13 | C12 | C27 | C28 | 72.7° | 71.7° |
| C13 | C12 | C15 | C16 | 114.3° | 59.3° |
| C12 | C13 | C14 | H141 | 115.9° | 173.9° |
| C12 | C13 | C14 | H142 | 124.1° | 53.9° |
| C12 | C13 | C14 | H143 | 4.1° | 66.0° |
| C13 | C12 | C15 | H15 | 65.7° | 116.0° |
| C27 | C12 | C15 | H12 | 116.6° | 114.8° |
| C12 | C27 | C10 | C32 | 118.5° | 116.3° |
| C12 | C27 | C10 | C28 | 120.4° | 121.0° |
| C12 | C27 | C32 | C28 | 127.2° | 121.7° |
| C12 | C27 | C10 | C9 | 65.4° | 57.8° |
| C27 | C12 | C15 | C16 | 121.2° | 74.7° |
| C12 | C27 | C32 | C33 | 23.3° | 3.2° |
| C12 | C27 | C32 | N31 | 159.9° | 179.9° |
| C12 | C27 | C28 | C46 | 98.3° | 170.6° |
| C27 | C12 | C15 | H15 | 58.8° | 109.9° |
| C12 | C27 | C10 | H101 | 174.6° | 177.9° |
| C12 | C27 | C10 | H102 | 53.0° | 62.1° |
| C12 | C27 | C28 | H281 | 141.7° | 45.6° |
| C12 | C27 | C28 | H282 | 19.4° | 66.4° |
| C15 | C12 | C27 | C10 | 168.6° | 175.6° |
| C15 | C12 | C27 | C32 | 78.8° | 60.4° |
| C15 | C12 | C27 | C28 | 49.5° | 61.9° |
| C12 | C15 | C16 | H15 | 180.0° | 175.5° |
| C12 | C15 | C16 | C19 | 0.2° | 0.7° |
| C12 | C15 | C16 | C17 | 179.7° | 177.7° |
| C10 | C27 | C32 | C28 | 118.4° | 123.5° |
| C27 | C10 | C9 | H101 | 120.0° | 125.0° |
| C27 | C10 | C9 | H102 | 118.4° | 119.6° |
| C10 | C27 | C32 | C33 | 91.2° | 111.6° |
| C10 | C27 | C32 | N31 | 85.7° | 65.3° |
| C10 | C27 | C28 | C46 | 144.2° | 51.8° |
| C27 | C10 | C9 | H91C | 169.2° | 154.1° |
| C27 | C10 | C9 | H92C | 70.4° | 88.8° |
| C10 | C27 | C12 | H12 | 72.2° | 59.8° |
| C27 | C10 | H101 | H102 | 118.5° | 116.6° |
| C10 | C27 | C28 | H281 | 24.2° | 73.2° |
| C10 | C27 | C28 | H282 | 98.0° | 174.7° |
| C32 | C27 | C10 | C9 | 176.1° | 174.1° |
| C27 | C32 | C33 | C34 | 163.2° | 137.8° |
| C27 | C32 | C33 | N31 | 177.0° | 177.2° |
| C27 | C32 | N31 | C30 | 2.1° | 1.4° |
| C32 | C27 | C28 | C46 | 29.3° | 68.6° |
| C32 | C27 | C12 | H12 | 40.4° | 55.4° |
| C32 | C27 | C10 | H101 | 56.1° | 61.6° |
| C32 | C27 | C10 | H102 | 65.5° | 54.2° |
| C32 | C27 | C28 | H281 | 90.7° | 166.4° |
| C32 | C27 | C28 | H282 | 147.1° | 54.4° |
| C27 | C32 | C33 | H331 | 76.8° | 104.9° |
| C27 | C32 | C33 | H332 | 46.0° | 14.9° |
| C28 | C27 | C10 | C9 | 55.0° | 63.2° |
| C28 | C27 | C32 | C33 | 150.4° | 124.9° |
| C28 | C27 | C32 | N31 | 32.7° | 58.2° |
| C27 | C28 | C46 | C29 | 89.9° | 56.5° |
| C27 | C28 | C46 | C22 | 144.2° | 75.5° |
| C27 | C28 | C46 | H281 | 120.0° | 124.9° |
| C27 | C28 | C46 | H282 | 117.8° | 122.9° |
| C28 | C27 | C12 | H12 | 168.6° | 177.8° |
| C28 | C27 | C10 | H101 | 65.0° | 61.2° |
| C28 | C27 | C10 | H102 | 173.4° | 176.9° |
| C27 | C28 | H281 | H282 | 118.0° | 113.6° |
| C27 | C28 | C46 | H46 | 27.1° | 171.3° |
| C10 | C9 | H91C | H92C | 119.6° | 120.2° |
| C9 | C10 | H101 | H102 | 118.5° | 116.6° |
| C15 | C16 | C19 | C17 | 179.5° | 178.4° |
| C15 | C16 | C17 | O20 | 125.6° | 128.3° |
| C15 | C16 | C17 | C18 | 112.8° | 112.2° |
| C16 | C15 | C12 | H12 | 4.7° | 170.4° |
| C15 | C16 | C19 | H191 | 121.4° | 0.1° |
| C15 | C16 | C19 | H192 | 118.5° | 120.0° |
| C15 | C16 | C19 | H193 | 1.4° | 120.0° |
| C15 | C16 | C17 | H17 | 6.8° | 8.4° |
| C19 | C16 | C17 | O20 | 54.0° | 53.1° |
| C19 | C16 | C17 | C18 | 67.6° | 66.4° |
| C19 | C16 | C15 | H15 | 179.8° | 176.2° |
| C16 | C19 | H191 | H192 | 120.0° | 120.0° |
| C16 | C19 | H191 | H193 | 120.0° | 119.9° |
| C16 | C19 | H192 | H193 | 120.0° | 120.0° |
| C19 | C16 | C17 | H17 | 172.7° | 173.0° |
| C16 | C17 | O20 | C18 | 121.8° | 119.1° |
| C16 | C17 | O20 | H17 | 118.5° | 119.3° |
| C16 | C17 | C18 | H17 | 118.6° | 119.7° |
| C16 | C17 | C18 | C21 | 164.8° | 138.8° |
| C17 | C16 | C15 | H15 | 0.3° | 2.3° |
| C17 | C16 | C19 | H191 | 59.1° | 178.5° |
| C17 | C16 | C19 | H192 | 61.0° | 58.4° |
| C17 | C16 | C19 | H193 | 179.1° | 61.6° |
| C16 | C17 | O20 | H20 | 131.8° | 60.0° |
| C16 | C17 | C18 | H181 | 75.2° | 100.4° |
| C16 | C17 | C18 | H182 | 46.4° | 18.3° |
| O20 | C17 | C18 | H17 | 118.8° | 121.2° |
| O20 | C17 | C18 | C21 | 72.6° | 102.1° |
| O20 | C17 | C18 | H181 | 47.4° | 18.6° |
| O20 | C17 | C18 | H182 | 169.0° | 137.4° |
| C17 | C18 | C21 | H181 | 120.0° | 120.7° |
| C17 | C18 | C21 | H182 | 118.4° | 120.7° |
| C17 | C18 | C21 | O48 | 177.7° | 9.3° |
| C17 | C18 | C21 | C81 | 60.5° | 127.8° |
| C18 | C17 | O20 | H20 | 106.4° | 179.1° |
| C17 | C18 | H181 | H182 | 118.5° | 119.2° |
| C17 | C18 | C21 | H21 | 59.3° | 112.4° |
| C18 | C21 | O48 | C81 | 121.3° | 120.2° |
| C18 | C21 | O48 | H21 | 119.1° | 122.0° |
| C18 | C21 | C81 | H21 | 119.3° | 120.5° |
| C18 | C21 | O48 | C23 | 130.3° | 144.3° |
| C18 | C21 | C81 | C80 | 136.1° | 146.1° |
| C21 | C18 | C17 | H17 | 46.2° | 19.1° |
| C21 | C18 | H181 | H182 | 118.5° | 118.7° |
| C18 | C21 | C81 | H811 | 16.1° | 27.7° |
| C18 | C21 | C81 | H812 | 102.5° | 95.2° |
| O48 | C21 | C81 | H21 | 123.0° | 118.2° |
| O48 | C21 | C81 | C80 | 18.3° | 24.8° |
| C21 | O48 | C23 | C80 | 3.9° | 13.2° |
| C21 | O48 | C23 | O44 | 115.0° | 133.7° |
| C21 | O48 | C23 | C55 | 131.4° | 107.5° |
| O48 | C21 | C18 | H181 | 62.3° | 111.4° |
| O48 | C21 | C18 | H182 | 59.3° | 130.0° |
| O48 | C21 | C81 | H811 | 101.7° | 93.7° |
| O48 | C21 | C81 | H812 | 139.8° | 143.4° |
| C81 | C21 | O48 | C23 | 9.1° | 24.1° |
| C21 | C81 | C80 | H811 | 120.0° | 118.5° |
| C21 | C81 | C80 | H812 | 121.5° | 118.6° |
| C21 | C81 | C80 | C23 | 20.1° | 16.4° |
| C81 | C21 | C18 | H181 | 179.5° | 7.0° |
| C81 | C21 | C18 | H182 | 58.0° | 111.5° |
| C21 | C81 | H811 | H812 | 121.6° | 122.8° |
| C21 | C81 | C80 | H801 | 140.1° | 135.1° |
| C21 | C81 | C80 | H802 | 101.8° | 102.6° |
| O48 | C23 | C80 | C81 | 15.2° | 3.0° |
| O48 | C23 | C80 | O44 | 119.1° | 120.5° |
| O48 | C23 | C80 | C55 | 123.5° | 120.9° |
| O48 | C23 | O44 | C55 | 117.2° | 120.5° |
| O48 | C23 | O44 | C43 | 83.8° | 93.7° |
| O48 | C23 | C55 | C42 | 92.9° | 108.6° |
| C23 | O48 | C21 | H21 | 110.5° | 93.7° |
| O48 | C23 | C80 | H801 | 135.2° | 121.8° |
| O48 | C23 | C80 | H802 | 106.7° | 115.9° |
| O48 | C23 | C55 | H551 | 147.1° | 132.8° |
| O48 | C23 | C55 | H552 | 29.0° | 10.2° |
| C81 | C80 | C23 | H801 | 120.0° | 118.8° |
| C81 | C80 | C23 | H802 | 121.9° | 118.9° |
| C81 | C80 | C23 | O44 | 103.9° | 117.5° |
| C81 | C80 | C23 | C55 | 138.7° | 123.9° |
| C80 | C81 | C21 | H21 | 104.6° | 93.4° |
| C80 | C81 | H811 | H812 | 121.6° | 122.9° |
| C81 | C80 | H801 | H802 | 122.1° | 122.3° |
| C80 | C23 | O44 | C55 | 124.9° | 120.0° |
| C80 | C23 | O44 | C43 | 158.3° | 146.8° |
| C80 | C23 | C55 | C42 | 144.5° | 131.7° |
| C23 | C80 | C81 | H811 | 99.9° | 102.1° |
| C23 | C80 | C81 | H812 | 141.6° | 135.0° |
| C23 | C80 | H801 | H802 | 122.0° | 122.4° |
| C80 | C23 | C55 | H551 | 24.6° | 13.0° |
| C80 | C23 | C55 | H552 | 93.5° | 109.5° |
| O44 | C23 | C55 | C42 | 24.2° | 11.7° |
| C23 | O44 | C43 | C42 | 27.5° | 31.0° |
| C23 | O44 | C43 | C51 | 150.8° | 151.2° |
| C23 | O44 | C43 | O47 | 88.9° | 87.8° |
| O44 | C23 | C80 | H801 | 16.1° | 1.3° |
| O44 | C23 | C80 | H802 | 134.2° | 123.6° |
| O44 | C23 | C55 | H551 | 95.8° | 107.0° |
| O44 | C23 | C55 | H552 | 146.1° | 130.5° |
| C55 | C23 | O44 | C43 | 33.4° | 26.8° |
| C23 | C55 | C42 | H551 | 120.0° | 118.9° |
| C23 | C55 | C42 | H552 | 121.9° | 119.0° |
| C23 | C55 | C42 | C43 | 8.6° | 6.4° |
| C55 | C23 | C80 | H801 | 101.3° | 117.3° |
| C55 | C23 | C80 | H802 | 16.8° | 5.0° |
| C23 | C55 | H551 | H552 | 122.1° | 122.8° |
| C23 | C55 | C42 | H421 | 128.6° | 112.8° |
| C23 | C55 | C42 | H422 | 112.5° | 125.0° |
| O44 | C43 | C42 | C55 | 10.0° | 22.4° |
| O44 | C43 | C42 | C51 | 118.9° | 119.5° |
| O44 | C43 | C42 | O47 | 115.8° | 118.6° |
| O44 | C43 | C51 | O47 | 119.3° | 120.6° |
| O44 | C43 | C51 | C53 | 174.8° | 175.9° |
| O44 | C43 | C51 | O52 | 54.6° | 55.8° |
| O44 | C43 | C51 | C50 | 63.3° | 63.6° |
| O44 | C43 | O47 | C48 | 53.0° | 58.4° |
| O44 | C43 | C42 | H421 | 110.0° | 96.2° |
| O44 | C43 | C42 | H422 | 131.1° | 140.9° |
| C55 | C42 | C43 | H421 | 120.0° | 118.6° |
| C55 | C42 | C43 | H422 | 121.1° | 118.5° |
| C55 | C42 | C43 | C51 | 128.9° | 141.9° |
| C55 | C42 | C43 | O47 | 105.7° | 96.2° |
| C42 | C55 | H551 | H552 | 122.1° | 122.0° |
| C55 | C42 | H421 | H422 | 121.1° | 122.0° |
| C42 | C43 | C51 | O47 | 125.0° | 121.8° |
| C42 | C43 | C51 | C53 | 59.2° | 58.3° |
| C42 | C43 | C51 | O52 | 61.1° | 61.8° |
| C42 | C43 | C51 | C50 | 178.9° | 178.8° |
| C42 | C43 | O47 | C48 | 165.2° | 175.2° |
| C43 | C42 | C55 | H551 | 111.4° | 125.4° |
| C43 | C42 | C55 | H552 | 130.5° | 112.6° |
| C43 | C42 | H421 | H422 | 121.2° | 123.0° |
| C43 | C51 | C53 | O52 | 119.9° | 120.1° |
| C43 | C51 | C53 | C50 | 120.9° | 120.2° |
| C43 | C51 | O52 | C50 | 117.1° | 119.4° |
| C43 | C51 | C50 | C49 | 47.4° | 53.7° |
| C51 | C43 | O47 | C48 | 66.4° | 62.4° |
| C51 | C43 | C42 | H421 | 8.9° | 23.3° |
| C51 | C43 | C42 | H422 | 110.0° | 99.6° |
| C43 | C51 | C53 | H531 | 118.6° | 59.9° |
| C43 | C51 | C53 | H532 | 1.3° | 180.0° |
| C43 | C51 | C53 | H533 | 121.4° | 60.0° |
| C43 | C51 | O52 | H52 | 56.2° | 180.0° |
| C43 | C51 | C50 | H501 | 72.5° | 66.8° |
| C43 | C51 | C50 | H502 | 165.5° | 174.2° |
| O47 | C43 | C51 | C53 | 65.9° | 63.5° |
| O47 | C43 | C51 | O52 | 173.9° | 176.5° |
| O47 | C43 | C51 | C50 | 56.1° | 57.1° |
| C43 | O47 | C48 | C49 | 60.3° | 60.3° |
| C43 | O47 | C48 | C37 | 177.5° | 179.4° |
| O47 | C43 | C42 | H421 | 134.2° | 145.2° |
| O47 | C43 | C42 | H422 | 15.3° | 22.2° |
| C43 | O47 | C48 | H48 | 58.8° | 60.5° |
| C53 | C51 | O52 | C50 | 119.5° | 120.1° |
| C53 | C51 | C50 | C49 | 76.7° | 67.0° |
| C51 | C53 | H531 | H532 | 120.0° | 120.1° |
| C51 | C53 | H531 | H533 | 120.0° | 119.9° |
| C51 | C53 | H532 | H533 | 120.0° | 120.0° |
| C53 | C51 | O52 | H52 | 179.5° | 59.4° |
| C53 | C51 | C50 | H501 | 163.3° | 172.5° |
| C53 | C51 | C50 | H502 | 41.3° | 53.5° |
| O52 | C51 | C50 | C49 | 164.5° | 173.2° |
| O52 | C51 | C53 | H531 | 1.3° | 179.9° |
| O52 | C51 | C53 | H532 | 121.3° | 59.9° |
| O52 | C51 | C53 | H533 | 118.7° | 60.1° |
| O52 | C51 | C50 | H501 | 44.5° | 52.7° |
| O52 | C51 | C50 | H502 | 77.4° | 66.3° |
| C51 | C50 | C49 | H501 | 120.0° | 120.4° |
| C51 | C50 | C49 | H502 | 118.0° | 120.5° |
| C51 | C50 | C49 | C48 | 45.6° | 52.9° |
| C50 | C51 | C53 | H531 | 120.4° | 60.2° |
| C50 | C51 | C53 | H532 | 119.6° | 59.8° |
| C50 | C51 | C53 | H533 | 0.5° | 179.8° |
| C50 | C51 | O52 | H52 | 61.0° | 60.6° |
| C51 | C50 | H501 | H502 | 118.2° | 119.2° |
| C51 | C50 | C49 | H491 | 165.5° | 172.8° |
| C51 | C50 | C49 | H492 | 72.5° | 68.5° |
| C50 | C49 | C48 | H491 | 120.0° | 119.8° |
| C50 | C49 | C48 | H492 | 118.0° | 121.7° |
| C50 | C49 | C48 | O47 | 48.6° | 54.3° |
| C50 | C49 | C48 | C37 | 168.9° | 172.9° |
| C49 | C50 | H501 | H502 | 118.2° | 119.4° |
| C50 | C49 | H491 | H492 | 118.2° | 119.7° |
| C50 | C49 | C48 | H48 | 72.5° | 66.2° |
| C49 | C48 | O47 | C37 | 122.3° | 119.1° |
| C49 | C48 | O47 | H48 | 119.0° | 120.7° |
| C49 | C48 | C37 | H48 | 119.0° | 120.8° |
| C49 | C48 | C37 | C36 | 63.6° | 97.6° |
| C48 | C49 | C50 | H501 | 74.4° | 67.5° |
| C48 | C49 | C50 | H502 | 163.6° | 173.4° |
| C48 | C49 | H491 | H492 | 118.2° | 119.3° |
| C49 | C48 | C37 | H371 | 56.4° | 23.3° |
| C49 | C48 | C37 | H372 | 178.1° | 142.2° |
| O47 | C48 | C37 | H48 | 121.0° | 119.9° |
| O47 | C48 | C37 | C36 | 176.4° | 143.1° |
| O47 | C48 | C49 | H491 | 168.6° | 174.0° |
| O47 | C48 | C49 | H492 | 69.5° | 67.5° |
| O47 | C48 | C37 | H371 | 63.6° | 96.0° |
| O47 | C48 | C37 | H372 | 58.1° | 22.9° |
| C48 | C37 | C36 | H371 | 120.0° | 120.7° |
| C48 | C37 | C36 | H372 | 118.3° | 119.8° |
| C48 | C37 | C36 | C38 | 115.5° | 54.4° |
| C48 | C37 | C36 | C35 | 63.8° | 126.0° |
| C37 | C48 | C49 | H491 | 71.1° | 67.3° |
| C37 | C48 | C49 | H492 | 50.8° | 51.2° |
| C48 | C37 | H371 | H372 | 118.4° | 118.7° |
| C37 | C36 | C38 | C35 | 179.4° | 179.6° |
| C37 | C36 | C35 | C34 | 176.9° | 43.5° |
| C36 | C37 | C48 | H48 | 55.4° | 23.3° |
| C36 | C37 | H371 | H372 | 118.4° | 119.8° |
| C37 | C36 | C38 | H381 | 180.0° | 0.0° |
| C37 | C36 | C38 | H382 | 0.0° | 180.0° |
| C37 | C36 | C35 | H351 | 63.1° | 77.3° |
| C37 | C36 | C35 | H352 | 58.8° | 163.3° |
| C38 | C36 | C35 | C34 | 2.5° | 136.1° |
| C38 | C36 | C37 | H371 | 4.5° | 66.3° |
| C38 | C36 | C37 | H372 | 126.2° | 174.2° |
| C36 | C38 | H381 | H382 | 180.0° | 180.0° |
| C38 | C36 | C35 | H351 | 117.5° | 103.1° |
| C38 | C36 | C35 | H352 | 120.6° | 16.3° |
| C36 | C35 | C34 | H351 | 120.0° | 120.6° |
| C36 | C35 | C34 | H352 | 118.0° | 119.5° |
| C36 | C35 | C34 | C33 | 178.4° | 143.2° |
| C35 | C36 | C37 | H371 | 176.2° | 113.3° |
| C35 | C36 | C37 | H372 | 54.4° | 6.3° |
| C35 | C36 | C38 | H381 | 0.6° | 179.6° |
| C35 | C36 | C38 | H382 | 179.3° | 0.4° |
| C36 | C35 | H351 | H352 | 118.2° | 119.1° |
| C36 | C35 | C34 | H341 | 61.6° | 96.8° |
| C36 | C35 | C34 | H342 | 58.6° | 22.9° |
| C35 | C34 | C33 | H341 | 120.0° | 120.1° |
| C35 | C34 | C33 | H342 | 119.7° | 120.9° |
| C35 | C34 | C33 | C32 | 84.2° | 73.6° |
| C34 | C35 | H351 | H352 | 118.2° | 119.9° |
| C35 | C34 | H341 | H342 | 119.7° | 120.4° |
| C35 | C34 | C33 | H331 | 155.8° | 169.2° |
| C35 | C34 | C33 | H332 | 33.0° | 50.2° |
| C34 | C33 | C32 | H331 | 120.0° | 117.3° |
| C34 | C33 | C32 | H332 | 117.2° | 122.8° |
| C34 | C33 | C32 | N31 | 19.9° | 45.1° |
| C33 | C34 | C35 | H351 | 58.4° | 22.6° |
| C33 | C34 | C35 | H352 | 63.6° | 97.3° |
| C33 | C34 | H341 | H342 | 119.7° | 119.1° |
| C34 | C33 | H331 | H332 | 117.5° | 120.2° |
| C33 | C32 | N31 | C30 | 179.1° | 175.7° |
| C32 | C33 | C34 | H341 | 35.8° | 46.5° |
| C32 | C33 | C34 | H342 | 156.1° | 165.5° |
| C32 | C33 | H331 | H332 | 117.5° | 122.0° |
| C32 | N31 | C30 | C29 | 70.8° | 67.6° |
| N31 | C32 | C33 | H331 | 100.1° | 72.3° |
| N31 | C32 | C33 | H332 | 137.1° | 167.9° |
| C32 | N31 | C30 | H301 | 169.2° | 174.3° |
| C32 | N31 | C30 | H302 | 49.4° | 57.1° |
| N31 | C30 | C29 | H301 | 120.0° | 118.4° |
| N31 | C30 | C29 | H302 | 120.2° | 125.1° |
| N31 | C30 | C29 | C6 | 78.0° | 45.8° |
| N31 | C30 | C29 | C46 | 45.9° | 78.2° |
| N31 | C30 | H301 | H302 | 120.2° | 120.8° |
| N31 | C30 | C29 | H29 | 163.4° | 162.5° |
| C30 | C29 | C6 | C46 | 124.4° | 125.2° |
| C30 | C29 | C6 | H29 | 118.0° | 116.9° |
| C30 | C29 | C46 | H29 | 117.9° | 118.9° |
| C30 | C29 | C46 | C22 | 163.5° | 74.5° |
| C30 | C29 | C46 | C28 | 38.4° | 59.0° |
| C29 | C30 | H301 | H302 | 120.2° | 119.5° |
| C30 | C29 | C6 | H61C | 146.4° | 60.0° |
| C30 | C29 | C6 | H62C | 93.6° | 180.0° |
| C30 | C29 | C6 | H63C | 26.4° | 60.0° |
| C30 | C29 | C46 | H46 | 79.6° | 174.3° |
| C6 | C29 | C46 | H29 | 118.6° | 117.3° |
| C6 | C29 | C46 | C22 | 72.9° | 161.8° |
| C6 | C29 | C46 | C28 | 161.9° | 64.7° |
| C6 | C29 | C30 | H301 | 42.0° | 72.6° |
| C6 | C29 | C30 | H302 | 161.8° | 171.0° |
| C29 | C6 | H61C | H62C | 120.0° | 119.9° |
| C29 | C6 | H61C | H63C | 120.0° | 120.0° |
| C29 | C6 | H62C | H63C | 120.0° | 120.0° |
| C6 | C29 | C46 | H46 | 44.0° | 50.6° |
| C29 | C46 | C22 | C28 | 125.2° | 134.8° |
| C29 | C46 | C22 | H46 | 116.8° | 111.4° |
| C29 | C46 | C28 | H46 | 117.0° | 114.9° |
| C29 | C46 | C28 | H281 | 30.1° | 178.6° |
| C29 | C46 | C28 | H282 | 152.3° | 66.5° |
| C46 | C29 | C30 | H301 | 165.9° | 163.4° |
| C46 | C29 | C30 | H302 | 74.3° | 46.9° |
| C46 | C29 | C6 | H61C | 89.2° | 174.8° |
| C46 | C29 | C6 | H62C | 30.8° | 54.8° |
| C46 | C29 | C6 | H63C | 150.8° | 65.2° |
| C29 | C46 | C22 | H221 | 41.3° | 60.0° |
| C29 | C46 | C22 | H222 | 161.4° | 179.9° |
| C29 | C46 | C22 | H223 | 78.6° | 60.0° |
| C22 | C46 | C28 | H46 | 117.0° | 113.2° |
| C22 | C46 | C28 | H281 | 95.8° | 49.4° |
| C22 | C46 | C28 | H282 | 26.4° | 161.6° |
| C22 | C46 | C29 | H29 | 45.7° | 44.4° |
| C46 | C22 | H221 | H222 | 120.0° | 120.0° |
| C46 | C22 | H221 | H223 | 120.0° | 120.0° |
| C46 | C22 | H222 | H223 | 120.0° | 120.0° |
| C46 | C28 | H281 | H282 | 117.9° | 113.9° |
| C28 | C46 | C29 | H29 | 79.5° | 178.0° |
| C28 | C46 | C22 | H221 | 83.8° | 74.7° |
| C28 | C46 | C22 | H222 | 36.2° | 45.3° |
| C28 | C46 | C22 | H223 | 156.2° | 165.2° |
| H4 | C4 | C3 | H31C | 138.7° | 138.6° |
| H4 | C4 | C3 | H32C | 20.0° | 14.8° |
| H4 | C4 | C7 | H71C | 93.3° | 179.1° |
| H4 | C4 | C7 | H72C | 26.7° | 59.2° |
| H4 | C4 | C7 | H73C | 146.7° | 60.9° |
| H2 | C2 | C3 | H31C | 137.8° | 149.9° |
| H2 | C2 | C3 | H32C | 19.1° | 26.3° |
| H71C | C7 | H72C | H73C | 120.0° | 119.9° |
| H91C | C9 | C10 | H101 | 70.7° | 80.9° |
| H91C | C9 | C10 | H102 | 50.8° | 34.5° |
| H92C | C9 | C10 | H101 | 49.6° | 36.3° |
| H92C | C9 | C10 | H102 | 171.2° | 151.7° |
| H141 | C14 | H142 | H143 | 120.0° | 120.0° |
| H12 | C12 | C15 | H15 | 175.4° | 4.9° |
| H281 | C28 | C46 | H46 | 147.1° | 63.8° |
| H282 | C28 | C46 | H46 | 90.7° | 48.4° |
| H191 | C19 | H192 | H193 | 120.0° | 120.0° |
| H17 | C17 | O20 | H20 | 13.3° | 59.4° |
| H17 | C17 | C18 | H181 | 166.2° | 139.9° |
| H17 | C17 | C18 | H182 | 72.2° | 101.4° |
| H181 | C18 | C21 | H21 | 60.7° | 126.8° |
| H182 | C18 | C21 | H21 | 177.7° | 8.3° |
| H21 | C21 | C81 | H811 | 135.4° | 148.2° |
| H21 | C21 | C81 | H812 | 16.8° | 25.2° |
| H811 | C81 | C80 | H801 | 20.1° | 16.6° |
| H811 | C81 | C80 | H802 | 138.2° | 138.9° |
| H812 | C81 | C80 | H801 | 98.4° | 106.3° |
| H812 | C81 | C80 | H802 | 19.7° | 16.0° |
| H551 | C55 | C42 | H421 | 8.6° | 6.1° |
| H551 | C55 | C42 | H422 | 127.5° | 116.0° |
| H552 | C55 | C42 | H421 | 109.5° | 128.1° |
| H552 | C55 | C42 | H422 | 9.4° | 6.0° |
| H531 | C53 | H532 | H533 | 120.0° | 120.0° |
| H501 | C50 | C49 | H491 | 45.6° | 52.4° |
| H501 | C50 | C49 | H492 | 167.6° | 171.0° |
| H502 | C50 | C49 | H491 | 76.4° | 66.7° |
| H502 | C50 | C49 | H492 | 45.6° | 51.9° |
| H491 | C49 | C48 | H48 | 47.5° | 53.5° |
| H492 | C49 | C48 | H48 | 169.5° | 172.0° |
| H48 | C48 | C37 | H371 | 175.4° | 144.1° |
| H48 | C48 | C37 | H372 | 62.9° | 97.0° |
| H351 | C35 | C34 | H341 | 178.4° | 142.6° |
| H351 | C35 | C34 | H342 | 61.4° | 97.7° |
| H352 | C35 | C34 | H341 | 56.4° | 22.7° |
| H352 | C35 | C34 | H342 | 176.7° | 142.4° |
| H341 | C34 | C33 | H331 | 84.2° | 70.7° |
| H341 | C34 | C33 | H332 | 153.0° | 170.3° |
| H342 | C34 | C33 | H331 | 36.1° | 48.3° |
| H342 | C34 | C33 | H332 | 86.7° | 70.7° |
| H301 | C30 | C29 | H29 | 76.6° | 44.1° |
| H302 | C30 | C29 | H29 | 43.2° | 72.3° |
| H29 | C29 | C6 | H61C | 28.4° | 56.9° |
| H29 | C29 | C6 | H62C | 148.4° | 63.1° |
| H29 | C29 | C6 | H63C | 91.6° | 176.9° |
| H29 | C29 | C46 | H46 | 162.6° | 66.7° |
| H61C | C6 | H62C | H63C | 120.0° | 120.1° |
| H46 | C46 | C22 | H221 | 158.2° | 171.5° |
| H46 | C46 | C22 | H222 | 81.8° | 68.5° |
| H46 | C46 | C22 | H223 | 38.2° | 51.4° |
| H221 | C22 | H222 | H223 | 120.0° | 120.0° |
