ZJY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F55 | C54 | sing | 1.37Å | 1.37Å | |
| C54 | F57 | sing | 1.37Å | 1.37Å | |
| C54 | F56 | sing | 1.37Å | 1.37Å | |
| C54 | C51 | sing | 1.54Å | 1.54Å | |
| C52 | C53 | sing | 1.54Å | 1.54Å | |
| C52 | C51 | sing | 1.53Å | 1.53Å | |
| C53 | C51 | sing | 1.53Å | 1.53Å | |
| C51 | C17 | sing | 1.55Å | 1.55Å | |
| C49 | C44 | sing | 1.54Å | 1.54Å | |
| C49 | C09 | sing | 1.53Å | 1.53Å | |
| C33 | C26 | sing | 1.54Å | 1.54Å | |
| C17 | O15 | sing | 1.41Å | 1.41Å | |
| C44 | C09 | sing | 1.54Å | 1.54Å | |
| C44 | C45 | sing | 1.54Å | 1.54Å | |
| C09 | N08 | sing | 1.49Å | 1.49Å | |
| C09 | C34 | sing | 1.55Å | 1.55Å | |
| N25 | C26 | doub | 1.46Å | 1.46Å | Aromatic |
| N25 | C24 | sing | 1.48Å | 1.48Å | Aromatic |
| O15 | C14 | sing | 1.42Å | 1.42Å | |
| N08 | C06 | sing | 1.47Å | 1.47Å | |
| C45 | C46 | doub | 1.34Å | 1.34Å | |
| C26 | C21 | sing | 1.55Å | 1.55Å | Aromatic |
| O36 | C34 | doub | 1.19Å | 1.19Å | |
| O12 | C10 | doub | 1.19Å | 1.19Å | |
| C34 | N35 | sing | 1.46Å | 1.46Å | |
| C30 | C24 | doub | 1.56Å | 1.56Å | Aromatic |
| C30 | C29 | sing | 1.54Å | 1.54Å | Aromatic |
| C14 | N13 | sing | 1.47Å | 1.47Å | |
| C14 | O16 | doub | 1.19Å | 1.19Å | |
| C24 | C23 | sing | 1.51Å | 1.51Å | Aromatic |
| C46 | C47 | sing | 1.55Å | 1.55Å | |
| N13 | C11 | sing | 1.45Å | 1.45Å | |
| O38 | S37 | doub | 1.47Å | 1.47Å | |
| C10 | N05 | sing | 1.48Å | 1.48Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C06 | C01 | sing | 1.49Å | 1.49Å | |
| C06 | O07 | doub | 1.19Å | 1.19Å | |
| N35 | S37 | sing | 1.71Å | 1.71Å | |
| C21 | O20 | sing | 1.41Å | 1.41Å | |
| C21 | N22 | doub | 1.46Å | 1.46Å | Aromatic |
| C01 | N05 | sing | 1.37Å | 1.37Å | |
| C01 | C02 | sing | 1.68Å | 1.68Å | |
| C47 | C48 | sing | 1.56Å | 1.56Å | |
| C29 | C28 | doub | 1.54Å | 1.54Å | Aromatic |
| O20 | C03 | sing | 1.46Å | 1.46Å | |
| N05 | C04 | sing | 1.60Å | 1.60Å | |
| C11 | C18 | sing | 1.54Å | 1.54Å | |
| C23 | N22 | sing | 1.48Å | 1.48Å | Aromatic |
| C23 | C27 | doub | 1.55Å | 1.55Å | Aromatic |
| S37 | O39 | doub | 1.47Å | 1.47Å | |
| S37 | C40 | sing | 1.83Å | 1.83Å | |
| C18 | C19 | sing | 1.56Å | 1.56Å | |
| C02 | C03 | sing | 1.31Å | 1.31Å | |
| C28 | C27 | sing | 1.54Å | 1.54Å | Aromatic |
| C28 | O31 | sing | 1.41Å | 1.41Å | |
| C03 | C04 | sing | 1.62Å | 1.62Å | |
| C42 | C40 | sing | 1.53Å | 1.53Å | |
| C42 | C41 | sing | 1.53Å | 1.53Å | |
| C48 | C50 | sing | 1.56Å | 1.56Å | |
| C40 | C41 | sing | 1.53Å | 1.53Å | |
| C40 | C43 | sing | 1.54Å | 1.54Å | |
| C19 | C50 | sing | 1.56Å | 1.56Å | |
| O31 | C32 | sing | 1.41Å | 1.41Å | |
| C17 | H172 | sing | 1.10Å | 1.10Å | |
| C17 | H171 | sing | 1.10Å | 1.10Å | |
| C01 | H011 | sing | 1.10Å | 1.10Å | |
| C02 | H022 | sing | 1.10Å | 1.10Å | |
| C02 | H021 | sing | 1.10Å | 1.10Å | |
| C03 | H031 | sing | 1.10Å | 1.10Å | |
| C04 | H041 | sing | 1.10Å | 1.10Å | |
| C04 | H042 | sing | 1.10Å | 1.10Å | |
| C11 | H111 | sing | 1.10Å | 1.10Å | |
| C18 | H181 | sing | 1.10Å | 1.10Å | |
| C18 | H182 | sing | 1.10Å | 1.10Å | |
| C19 | H192 | sing | 1.10Å | 1.10Å | |
| C19 | H191 | sing | 1.10Å | 1.10Å | |
| C27 | H271 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.08Å | 1.08Å | |
| C30 | H301 | sing | 1.08Å | 1.08Å | |
| C32 | H321 | sing | 1.10Å | 1.10Å | |
| C32 | H322 | sing | 1.10Å | 1.10Å | |
| C32 | H323 | sing | 1.10Å | 1.10Å | |
| C33 | H333 | sing | 1.10Å | 1.10Å | |
| C33 | H332 | sing | 1.10Å | 1.10Å | |
| C33 | H331 | sing | 1.10Å | 1.10Å | |
| C41 | H412 | sing | 1.10Å | 1.10Å | |
| C41 | H411 | sing | 1.10Å | 1.10Å | |
| C42 | H421 | sing | 1.10Å | 1.10Å | |
| C42 | H422 | sing | 1.10Å | 1.10Å | |
| C43 | H432 | sing | 1.10Å | 1.10Å | |
| C43 | H431 | sing | 1.10Å | 1.10Å | |
| C43 | H433 | sing | 1.10Å | 1.10Å | |
| C44 | H441 | sing | 1.10Å | 1.10Å | |
| C45 | H451 | sing | 1.08Å | 1.08Å | |
| C46 | H461 | sing | 1.08Å | 1.08Å | |
| C47 | H471 | sing | 1.10Å | 1.10Å | |
| C47 | H472 | sing | 1.10Å | 1.10Å | |
| C48 | H482 | sing | 1.10Å | 1.10Å | |
| C48 | H481 | sing | 1.10Å | 1.10Å | |
| C49 | H491 | sing | 1.10Å | 1.10Å | |
| C49 | H492 | sing | 1.10Å | 1.10Å | |
| C50 | H501 | sing | 1.10Å | 1.10Å | |
| C50 | H502 | sing | 1.10Å | 1.10Å | |
| C52 | H522 | sing | 1.10Å | 1.10Å | |
| C52 | H521 | sing | 1.10Å | 1.10Å | |
| C53 | H532 | sing | 1.10Å | 1.10Å | |
| C53 | H531 | sing | 1.10Å | 1.10Å | |
| N08 | H081 | sing | 1.00Å | 1.00Å | |
| N13 | H131 | sing | 1.00Å | 1.00Å | |
| N35 | H351 | sing | 1.00Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F55 | C54 | F57 | 109.8° | 109.8° |
| F55 | C54 | F56 | 109.8° | 109.8° |
| F55 | C54 | C51 | 110.6° | 110.6° |
| F57 | C54 | F56 | 109.7° | 109.7° |
| F57 | C54 | C51 | 108.5° | 108.5° |
| F56 | C54 | C51 | 108.4° | 108.4° |
| C54 | C51 | C52 | 117.6° | 117.6° |
| C54 | C51 | C53 | 115.1° | 115.1° |
| C54 | C51 | C17 | 118.4° | 118.4° |
| C53 | C52 | C51 | 60.0° | 60.0° |
| C52 | C53 | C51 | 59.9° | 59.9° |
| C53 | C52 | H522 | 120.0° | 120.0° |
| C53 | C52 | H521 | 120.0° | 120.0° |
| C52 | C53 | H532 | 120.0° | 120.0° |
| C52 | C53 | H531 | 120.0° | 120.0° |
| C52 | C51 | C53 | 60.1° | 60.1° |
| C52 | C51 | C17 | 117.2° | 117.2° |
| C51 | C52 | H522 | 120.0° | 120.0° |
| C51 | C52 | H521 | 120.0° | 120.0° |
| C53 | C51 | C17 | 115.1° | 115.1° |
| C51 | C53 | H532 | 120.0° | 120.0° |
| C51 | C53 | H531 | 120.0° | 120.0° |
| C51 | C17 | O15 | 107.1° | 107.1° |
| C51 | C17 | H172 | 110.1° | 110.1° |
| C51 | C17 | H171 | 110.1° | 110.1° |
| C44 | C49 | C09 | 60.3° | 60.3° |
| C49 | C44 | C09 | 59.5° | 59.5° |
| C49 | C44 | C45 | 115.3° | 115.3° |
| C49 | C44 | H441 | 109.9° | 109.9° |
| C44 | C49 | H491 | 119.9° | 119.9° |
| C44 | C49 | H492 | 119.9° | 119.9° |
| C49 | C09 | C44 | 60.2° | 60.2° |
| C49 | C09 | N08 | 133.0° | 133.0° |
| C49 | C09 | C34 | 107.2° | 107.2° |
| C09 | C49 | H491 | 119.9° | 119.9° |
| C09 | C49 | H492 | 119.9° | 119.9° |
| C33 | C26 | N25 | 119.9° | 119.9° |
| C33 | C26 | C21 | 120.2° | 120.2° |
| C26 | C33 | H333 | 109.5° | 109.5° |
| C26 | C33 | H332 | 109.4° | 109.4° |
| C26 | C33 | H331 | 109.4° | 109.4° |
| C17 | O15 | C14 | 114.6° | 114.6° |
| O15 | C17 | H172 | 110.1° | 110.1° |
| O15 | C17 | H171 | 110.1° | 110.1° |
| C09 | C44 | C45 | 138.7° | 138.7° |
| C44 | C09 | N08 | 113.4° | 113.4° |
| C44 | C09 | C34 | 107.0° | 107.0° |
| C09 | C44 | H441 | 109.9° | 109.9° |
| C44 | C45 | C46 | 123.6° | 123.6° |
| C45 | C44 | H441 | 109.8° | 109.8° |
| C44 | C45 | H451 | 118.1° | 118.2° |
| N08 | C09 | C34 | 118.2° | 118.2° |
| C09 | N08 | C06 | 126.7° | 126.7° |
| C09 | N08 | H081 | 116.7° | 116.7° |
| C09 | C34 | O36 | 120.4° | 120.4° |
| C09 | C34 | N35 | 121.8° | 121.8° |
| C26 | N25 | C24 | 119.8° | 119.8° |
| N25 | C26 | C21 | 119.9° | 119.9° |
| N25 | C24 | C30 | 120.2° | 120.2° |
| N25 | C24 | C23 | 120.0° | 120.0° |
| O15 | C14 | N13 | 118.4° | 118.4° |
| O15 | C14 | O16 | 120.9° | 120.9° |
| N08 | C06 | C01 | 114.9° | 114.9° |
| N08 | C06 | O07 | 122.7° | 122.7° |
| C06 | N08 | H081 | 116.6° | 116.6° |
| C45 | C46 | C47 | 123.0° | 123.0° |
| C46 | C45 | H451 | 118.2° | 118.2° |
| C45 | C46 | H461 | 118.5° | 118.5° |
| C26 | C21 | O20 | 119.9° | 119.9° |
| C26 | C21 | N22 | 120.2° | 120.2° |
| O36 | C34 | N35 | 117.8° | 117.8° |
| O12 | C10 | N05 | 119.4° | 119.4° |
| O12 | C10 | C11 | 120.8° | 120.8° |
| C34 | N35 | S37 | 117.4° | 117.4° |
| C34 | N35 | H351 | 121.3° | 121.3° |
| C24 | C30 | C29 | 119.7° | 119.7° |
| C30 | C24 | C23 | 119.8° | 119.8° |
| C24 | C30 | H301 | 120.1° | 120.1° |
| C30 | C29 | C28 | 120.1° | 120.1° |
| C30 | C29 | H291 | 120.0° | 120.0° |
| C29 | C30 | H301 | 120.1° | 120.1° |
| N13 | C14 | O16 | 120.7° | 120.7° |
| C14 | N13 | C11 | 120.2° | 120.2° |
| C14 | N13 | H131 | 119.9° | 119.9° |
| C24 | C23 | N22 | 120.7° | 120.7° |
| C24 | C23 | C27 | 120.6° | 120.6° |
| C46 | C47 | C48 | 108.3° | 108.3° |
| C47 | C46 | H461 | 118.5° | 118.5° |
| C46 | C47 | H471 | 109.7° | 109.7° |
| C46 | C47 | H472 | 109.8° | 109.8° |
| N13 | C11 | C10 | 109.1° | 109.1° |
| N13 | C11 | C18 | 109.5° | 109.5° |
| N13 | C11 | H111 | 110.5° | 110.5° |
| C11 | N13 | H131 | 119.9° | 119.9° |
| O38 | S37 | N35 | 111.4° | 111.4° |
| O38 | S37 | O39 | 102.8° | 102.8° |
| O38 | S37 | C40 | 112.1° | 112.1° |
| N05 | C10 | C11 | 119.7° | 119.7° |
| C10 | N05 | C01 | 126.6° | 126.6° |
| C10 | N05 | C04 | 127.4° | 127.4° |
| C10 | C11 | C18 | 109.2° | 109.2° |
| C10 | C11 | H111 | 109.3° | 109.3° |
| C01 | C06 | O07 | 122.4° | 122.4° |
| C06 | C01 | N05 | 104.3° | 104.3° |
| C06 | C01 | C02 | 118.2° | 118.2° |
| C06 | C01 | H011 | 109.7° | 109.7° |
| N35 | S37 | O39 | 110.9° | 110.9° |
| N35 | S37 | C40 | 109.1° | 109.1° |
| S37 | N35 | H351 | 121.3° | 121.3° |
| O20 | C21 | N22 | 119.9° | 119.9° |
| C21 | O20 | C03 | 112.5° | 112.5° |
| C21 | N22 | C23 | 119.5° | 119.5° |
| N05 | C01 | C02 | 105.7° | 105.7° |
| C01 | N05 | C04 | 106.0° | 106.0° |
| N05 | C01 | H011 | 111.5° | 111.5° |
| C01 | C02 | C03 | 101.0° | 101.0° |
| C02 | C01 | H011 | 107.4° | 107.4° |
| C01 | C02 | H022 | 111.5° | 111.5° |
| C01 | C02 | H021 | 111.5° | 111.5° |
| C47 | C48 | C50 | 109.8° | 109.8° |
| C48 | C47 | H471 | 109.8° | 109.8° |
| C48 | C47 | H472 | 109.8° | 109.7° |
| C47 | C48 | H482 | 109.4° | 109.4° |
| C47 | C48 | H481 | 109.4° | 109.4° |
| C29 | C28 | C27 | 120.1° | 120.1° |
| C29 | C28 | O31 | 120.2° | 120.2° |
| C28 | C29 | H291 | 119.9° | 119.9° |
| O20 | C03 | C02 | 112.6° | 112.6° |
| O20 | C03 | C04 | 104.3° | 104.3° |
| O20 | C03 | H031 | 112.5° | 112.5° |
| N05 | C04 | C03 | 97.9° | 97.9° |
| N05 | C04 | H041 | 112.3° | 112.3° |
| N05 | C04 | H042 | 112.3° | 112.3° |
| C11 | C18 | C19 | 110.8° | 110.8° |
| C18 | C11 | H111 | 109.2° | 109.2° |
| C11 | C18 | H181 | 109.1° | 109.1° |
| C11 | C18 | H182 | 109.1° | 109.1° |
| N22 | C23 | C27 | 118.7° | 118.7° |
| C23 | C27 | C28 | 119.7° | 119.7° |
| C23 | C27 | H271 | 120.2° | 120.2° |
| O39 | S37 | C40 | 110.4° | 110.4° |
| S37 | C40 | C42 | 115.2° | 115.2° |
| S37 | C40 | C41 | 115.9° | 115.9° |
| S37 | C40 | C43 | 119.8° | 119.8° |
| C18 | C19 | C50 | 108.7° | 108.7° |
| C19 | C18 | H181 | 109.1° | 109.1° |
| C19 | C18 | H182 | 109.1° | 109.1° |
| C18 | C19 | H192 | 109.7° | 109.7° |
| C18 | C19 | H191 | 109.7° | 109.7° |
| C02 | C03 | C04 | 101.1° | 101.1° |
| C03 | C02 | H022 | 111.5° | 111.5° |
| C03 | C02 | H021 | 111.6° | 111.6° |
| C02 | C03 | H031 | 115.1° | 115.1° |
| C27 | C28 | O31 | 119.7° | 119.7° |
| C28 | C27 | H271 | 120.2° | 120.1° |
| C28 | O31 | C32 | 115.0° | 115.0° |
| C04 | C03 | H031 | 110.1° | 110.1° |
| C03 | C04 | H041 | 112.3° | 112.3° |
| C03 | C04 | H042 | 112.3° | 112.3° |
| C40 | C42 | C41 | 60.0° | 60.0° |
| C42 | C40 | C41 | 60.1° | 60.1° |
| C42 | C40 | C43 | 115.9° | 115.9° |
| C40 | C42 | H421 | 120.0° | 120.0° |
| C40 | C42 | H422 | 120.0° | 120.0° |
| C42 | C41 | C40 | 59.9° | 59.9° |
| C42 | C41 | H412 | 120.0° | 120.0° |
| C42 | C41 | H411 | 120.0° | 120.0° |
| C41 | C42 | H421 | 120.0° | 120.0° |
| C41 | C42 | H422 | 120.0° | 120.0° |
| C48 | C50 | C19 | 109.6° | 109.6° |
| C50 | C48 | H482 | 109.4° | 109.4° |
| C50 | C48 | H481 | 109.4° | 109.4° |
| C48 | C50 | H501 | 109.4° | 109.4° |
| C48 | C50 | H502 | 109.4° | 109.4° |
| C41 | C40 | C43 | 115.9° | 115.9° |
| C40 | C41 | H412 | 120.0° | 120.0° |
| C40 | C41 | H411 | 120.0° | 120.0° |
| C40 | C43 | H432 | 109.5° | 109.5° |
| C40 | C43 | H431 | 109.5° | 109.5° |
| C40 | C43 | H433 | 109.5° | 109.5° |
| C50 | C19 | H192 | 109.7° | 109.7° |
| C50 | C19 | H191 | 109.7° | 109.7° |
| C19 | C50 | H501 | 109.4° | 109.4° |
| C19 | C50 | H502 | 109.4° | 109.4° |
| O31 | C32 | H321 | 109.5° | 109.5° |
| O31 | C32 | H322 | 109.5° | 109.5° |
| O31 | C32 | H323 | 109.5° | 109.5° |
| H172 | C17 | H171 | 109.4° | 109.4° |
| H022 | C02 | H021 | 109.5° | 109.5° |
| H041 | C04 | H042 | 109.4° | 109.4° |
| H181 | C18 | H182 | 109.5° | 109.5° |
| H192 | C19 | H191 | 109.4° | 109.4° |
| H321 | C32 | H322 | 109.5° | 109.5° |
| H321 | C32 | H323 | 109.5° | 109.5° |
| H322 | C32 | H323 | 109.5° | 109.5° |
| H333 | C33 | H332 | 109.5° | 109.5° |
| H333 | C33 | H331 | 109.5° | 109.5° |
| H332 | C33 | H331 | 109.5° | 109.5° |
| H412 | C41 | H411 | 109.4° | 109.5° |
| H421 | C42 | H422 | 109.5° | 109.5° |
| H432 | C43 | H431 | 109.5° | 109.5° |
| H432 | C43 | H433 | 109.4° | 109.4° |
| H431 | C43 | H433 | 109.5° | 109.5° |
| H471 | C47 | H472 | 109.4° | 109.5° |
| H482 | C48 | H481 | 109.5° | 109.5° |
| H491 | C49 | H492 | 109.5° | 109.5° |
| H501 | C50 | H502 | 109.5° | 109.5° |
| H522 | C52 | H521 | 109.5° | 109.5° |
| H532 | C53 | H531 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F55 | C54 | F57 | F56 | 120.8° | 120.8° |
| F55 | C54 | F57 | C51 | 121.0° | 121.0° |
| F55 | C54 | F56 | C51 | 120.9° | 120.9° |
| F55 | C54 | C51 | C52 | 22.6° | 22.6° |
| F55 | C54 | C51 | C53 | 45.2° | 45.2° |
| F55 | C54 | C51 | C17 | 172.9° | 172.9° |
| F57 | C54 | F56 | C51 | 118.3° | 118.3° |
| F57 | C54 | C51 | C52 | 97.8° | 97.8° |
| F57 | C54 | C51 | C53 | 165.7° | 165.7° |
| F57 | C54 | C51 | C17 | 52.5° | 52.5° |
| F56 | C54 | C51 | C52 | 143.1° | 143.1° |
| F56 | C54 | C51 | C53 | 75.2° | 75.2° |
| F56 | C54 | C51 | C17 | 66.6° | 66.6° |
| C54 | C51 | C53 | C52 | 108.7° | 108.7° |
| C54 | C51 | C52 | C17 | 150.7° | 150.7° |
| C54 | C51 | C53 | C17 | 143.1° | 143.1° |
| C54 | C51 | C17 | O15 | 83.5° | 83.5° |
| C54 | C51 | C17 | H172 | 36.1° | 36.1° |
| C54 | C51 | C17 | H171 | 156.8° | 156.8° |
| C54 | C51 | C52 | H522 | 4.9° | 4.9° |
| C54 | C51 | C52 | H521 | 146.0° | 146.0° |
| C54 | C51 | C53 | H532 | 141.9° | 141.9° |
| C54 | C51 | C53 | H531 | 0.7° | 0.7° |
| C53 | C52 | C51 | H522 | 109.5° | 109.5° |
| C53 | C52 | C51 | H521 | 109.5° | 109.5° |
| C52 | C53 | C51 | H532 | 109.4° | 109.4° |
| C52 | C53 | C51 | H531 | 109.4° | 109.4° |
| C53 | C52 | C51 | C17 | 104.8° | 104.8° |
| C53 | C52 | H522 | H521 | 144.7° | 144.7° |
| C52 | C53 | H532 | H531 | 144.8° | 144.8° |
| C52 | C51 | C17 | O15 | 126.0° | 126.0° |
| C52 | C51 | C17 | H172 | 114.3° | 114.3° |
| C52 | C51 | C17 | H171 | 6.4° | 6.4° |
| C51 | C52 | H522 | H521 | 144.7° | 144.7° |
| C53 | C51 | C17 | O15 | 58.3° | 58.3° |
| C53 | C51 | C17 | H172 | 177.9° | 177.9° |
| C53 | C51 | C17 | H171 | 61.4° | 61.4° |
| C51 | C53 | H532 | H531 | 144.8° | 144.8° |
| C51 | C17 | O15 | H172 | 119.7° | 119.7° |
| C51 | C17 | O15 | H171 | 119.7° | 119.7° |
| C51 | C17 | O15 | C14 | 148.0° | 148.0° |
| C51 | C17 | H172 | H171 | 121.1° | 121.1° |
| C17 | C51 | C52 | H522 | 145.8° | 145.8° |
| C17 | C51 | C52 | H521 | 4.7° | 4.7° |
| C17 | C51 | C53 | H532 | 1.2° | 1.2° |
| C17 | C51 | C53 | H531 | 142.4° | 142.4° |
| C44 | C49 | C09 | H491 | 109.6° | 109.6° |
| C44 | C49 | C09 | H492 | 109.6° | 109.6° |
| C49 | C44 | C09 | C45 | 94.6° | 94.6° |
| C49 | C44 | C09 | H441 | 102.0° | 102.0° |
| C49 | C44 | C45 | H441 | 124.8° | 124.8° |
| C44 | C49 | C09 | N08 | 95.2° | 95.2° |
| C44 | C49 | C09 | C34 | 100.1° | 100.1° |
| C49 | C44 | C45 | C46 | 163.5° | 163.5° |
| C49 | C44 | C45 | H451 | 16.5° | 16.5° |
| C44 | C49 | H491 | H492 | 144.6° | 144.6° |
| C49 | C09 | N08 | C34 | 163.4° | 163.4° |
| C49 | C09 | N08 | C06 | 142.9° | 142.9° |
| C49 | C09 | C34 | O36 | 17.3° | 17.3° |
| C49 | C09 | C34 | N35 | 162.2° | 162.2° |
| C09 | C49 | H491 | H492 | 144.6° | 144.6° |
| C49 | C09 | N08 | H081 | 37.1° | 37.1° |
| C33 | C26 | N25 | C21 | 179.9° | 179.9° |
| C33 | C26 | N25 | C24 | 180.0° | 180.0° |
| C33 | C26 | C21 | O20 | 0.1° | 0.1° |
| C33 | C26 | C21 | N22 | 179.9° | 179.9° |
| C26 | C33 | H333 | H332 | 120.0° | 120.0° |
| C26 | C33 | H333 | H331 | 120.0° | 120.0° |
| C26 | C33 | H332 | H331 | 120.0° | 120.0° |
| C17 | O15 | C14 | N13 | 162.0° | 162.0° |
| C17 | O15 | C14 | O16 | 18.5° | 18.5° |
| O15 | C17 | H172 | H171 | 121.1° | 121.1° |
| C09 | C44 | C45 | H441 | 163.5° | 163.5° |
| C44 | C09 | N08 | C34 | 126.4° | 126.4° |
| C44 | C09 | N08 | C06 | 72.7° | 72.7° |
| C09 | C44 | C45 | C46 | 124.8° | 124.8° |
| C44 | C09 | C34 | O36 | 45.9° | 45.9° |
| C44 | C09 | C34 | N35 | 134.6° | 134.6° |
| C09 | C44 | C45 | H451 | 55.2° | 55.2° |
| C44 | C09 | N08 | H081 | 107.3° | 107.3° |
| C45 | C44 | C09 | N08 | 138.0° | 138.0° |
| C45 | C44 | C09 | C34 | 5.8° | 5.8° |
| C44 | C45 | C46 | H451 | 180.0° | 180.0° |
| C44 | C45 | C46 | C47 | 0.2° | 0.2° |
| C44 | C45 | C46 | H461 | 179.8° | 179.8° |
| C45 | C44 | C49 | H491 | 23.8° | 23.8° |
| C45 | C44 | C49 | H492 | 117.1° | 117.1° |
| C09 | N08 | C06 | H081 | 180.0° | 180.0° |
| N08 | C09 | C34 | O36 | 175.3° | 175.3° |
| N08 | C09 | C34 | N35 | 5.2° | 5.2° |
| C09 | N08 | C06 | C01 | 176.0° | 176.0° |
| C09 | N08 | C06 | O07 | 1.9° | 1.9° |
| N08 | C09 | C44 | H441 | 25.5° | 25.5° |
| N08 | C09 | C49 | H491 | 155.2° | 155.2° |
| N08 | C09 | C49 | H492 | 14.3° | 14.3° |
| C34 | C09 | N08 | C06 | 53.7° | 53.7° |
| C09 | C34 | O36 | N35 | 179.5° | 179.5° |
| C09 | C34 | N35 | S37 | 179.5° | 179.5° |
| C34 | C09 | C44 | H441 | 157.6° | 157.6° |
| C34 | C09 | C49 | H491 | 9.5° | 9.5° |
| C34 | C09 | C49 | H492 | 150.4° | 150.4° |
| C34 | C09 | N08 | H081 | 126.3° | 126.3° |
| C09 | C34 | N35 | H351 | 0.5° | 0.5° |
| C26 | N25 | C24 | C30 | 180.0° | 180.0° |
| C26 | N25 | C24 | C23 | 0.0° | 0.0° |
| N25 | C26 | C21 | O20 | 180.0° | 180.0° |
| N25 | C26 | C21 | N22 | 0.0° | 0.0° |
| N25 | C26 | C33 | H333 | 0.0° | 0.0° |
| N25 | C26 | C33 | H332 | 120.0° | 120.0° |
| N25 | C26 | C33 | H331 | 120.0° | 120.0° |
| C24 | N25 | C26 | C21 | 0.1° | 0.1° |
| N25 | C24 | C30 | C23 | 179.9° | 179.9° |
| N25 | C24 | C30 | C29 | 179.9° | 179.9° |
| N25 | C24 | C23 | N22 | 0.2° | 0.2° |
| N25 | C24 | C23 | C27 | 179.9° | 179.9° |
| N25 | C24 | C30 | H301 | 0.0° | 0.0° |
| O15 | C14 | N13 | O16 | 179.6° | 179.6° |
| O15 | C14 | N13 | C11 | 173.9° | 173.9° |
| C14 | O15 | C17 | H172 | 28.3° | 28.3° |
| C14 | O15 | C17 | H171 | 92.4° | 92.4° |
| O15 | C14 | N13 | H131 | 6.1° | 6.1° |
| N08 | C06 | C01 | O07 | 177.9° | 177.9° |
| N08 | C06 | C01 | N05 | 117.4° | 117.4° |
| N08 | C06 | C01 | C02 | 125.6° | 125.6° |
| N08 | C06 | C01 | H011 | 2.1° | 2.1° |
| C45 | C46 | C47 | H461 | 180.0° | 180.0° |
| C45 | C46 | C47 | C48 | 125.1° | 125.1° |
| C46 | C45 | C44 | H441 | 38.7° | 38.7° |
| C45 | C46 | C47 | H471 | 5.3° | 5.3° |
| C45 | C46 | C47 | H472 | 115.0° | 115.1° |
| C26 | C21 | O20 | N22 | 180.0° | 180.0° |
| C26 | C21 | O20 | C03 | 171.4° | 171.4° |
| C26 | C21 | N22 | C23 | 0.1° | 0.1° |
| C21 | C26 | C33 | H333 | 179.9° | 179.9° |
| C21 | C26 | C33 | H332 | 59.9° | 59.9° |
| C21 | C26 | C33 | H331 | 60.1° | 60.1° |
| O36 | C34 | N35 | S37 | 0.0° | 0.0° |
| O36 | C34 | N35 | H351 | 180.0° | 180.0° |
| O12 | C10 | C11 | N13 | 57.7° | 57.7° |
| O12 | C10 | N05 | C11 | 179.4° | 179.4° |
| O12 | C10 | N05 | C01 | 1.1° | 1.1° |
| O12 | C10 | N05 | C04 | 179.4° | 179.4° |
| O12 | C10 | C11 | C18 | 62.0° | 62.0° |
| O12 | C10 | C11 | H111 | 178.6° | 178.6° |
| C34 | N35 | S37 | O38 | 56.8° | 56.8° |
| C34 | N35 | S37 | H351 | 180.0° | 180.0° |
| C34 | N35 | S37 | O39 | 57.1° | 57.1° |
| C34 | N35 | S37 | C40 | 178.9° | 178.9° |
| C24 | C30 | C29 | H301 | 180.0° | 180.0° |
| C24 | C30 | C29 | C28 | 0.0° | 0.0° |
| C30 | C24 | C23 | N22 | 179.9° | 179.9° |
| C30 | C24 | C23 | C27 | 0.1° | 0.1° |
| C24 | C30 | C29 | H291 | 180.0° | 180.0° |
| C29 | C30 | C24 | C23 | 0.0° | 0.0° |
| C30 | C29 | C28 | H291 | 180.0° | 180.0° |
| C30 | C29 | C28 | C27 | 0.1° | 0.1° |
| C30 | C29 | C28 | O31 | 180.0° | 180.0° |
| C14 | N13 | C11 | H131 | 180.0° | 180.0° |
| C14 | N13 | C11 | C10 | 84.8° | 84.8° |
| C14 | N13 | C11 | C18 | 155.7° | 155.7° |
| C14 | N13 | C11 | H111 | 35.4° | 35.4° |
| O16 | C14 | N13 | C11 | 5.6° | 5.6° |
| O16 | C14 | N13 | H131 | 174.4° | 174.4° |
| C24 | C23 | N22 | C21 | 0.2° | 0.2° |
| C24 | C23 | N22 | C27 | 179.9° | 179.9° |
| C24 | C23 | C27 | C28 | 0.2° | 0.2° |
| C24 | C23 | C27 | H271 | 179.8° | 179.8° |
| C23 | C24 | C30 | H301 | 180.0° | 180.0° |
| C46 | C47 | C48 | H471 | 119.8° | 119.8° |
| C46 | C47 | C48 | H472 | 119.8° | 119.9° |
| C46 | C47 | C48 | C50 | 170.8° | 170.8° |
| C47 | C46 | C45 | H451 | 179.8° | 179.8° |
| C46 | C47 | H471 | H472 | 120.5° | 120.6° |
| C46 | C47 | C48 | H482 | 50.7° | 50.7° |
| C46 | C47 | C48 | H481 | 69.1° | 69.1° |
| N13 | C11 | C10 | N05 | 122.9° | 122.9° |
| N13 | C11 | C10 | C18 | 119.7° | 119.7° |
| N13 | C11 | C10 | H111 | 120.9° | 120.9° |
| N13 | C11 | C18 | H111 | 121.1° | 121.1° |
| N13 | C11 | C18 | C19 | 178.6° | 178.6° |
| N13 | C11 | C18 | H181 | 61.2° | 61.2° |
| N13 | C11 | C18 | H182 | 58.4° | 58.4° |
| O38 | S37 | N35 | O39 | 113.9° | 113.9° |
| O38 | S37 | N35 | C40 | 124.3° | 124.3° |
| O38 | S37 | O39 | C40 | 119.8° | 119.8° |
| O38 | S37 | C40 | C42 | 29.9° | 29.9° |
| O38 | S37 | C40 | C41 | 37.5° | 37.5° |
| O38 | S37 | C40 | C43 | 175.6° | 175.6° |
| O38 | S37 | N35 | H351 | 123.2° | 123.2° |
| C10 | N05 | C01 | C06 | 53.5° | 53.5° |
| C10 | N05 | C01 | C04 | 178.6° | 178.6° |
| C10 | N05 | C01 | C02 | 178.8° | 178.8° |
| N05 | C10 | C11 | C18 | 117.4° | 117.4° |
| C10 | N05 | C04 | C03 | 154.3° | 154.3° |
| C10 | N05 | C01 | H011 | 64.8° | 64.8° |
| C10 | N05 | C04 | H041 | 36.2° | 36.2° |
| C10 | N05 | C04 | H042 | 87.7° | 87.7° |
| N05 | C10 | C11 | H111 | 2.0° | 2.0° |
| C11 | C10 | N05 | C01 | 178.4° | 178.4° |
| C11 | C10 | N05 | C04 | 0.1° | 0.1° |
| C10 | C11 | C18 | H111 | 119.5° | 119.5° |
| C10 | C11 | C18 | C19 | 59.1° | 59.1° |
| C10 | C11 | C18 | H181 | 179.3° | 179.3° |
| C10 | C11 | C18 | H182 | 61.1° | 61.1° |
| C10 | C11 | N13 | H131 | 95.2° | 95.2° |
| C06 | C01 | N05 | C02 | 125.3° | 125.3° |
| C06 | C01 | N05 | H011 | 118.3° | 118.3° |
| C06 | C01 | C02 | H011 | 124.7° | 124.7° |
| C06 | C01 | N05 | C04 | 125.1° | 125.1° |
| C06 | C01 | C02 | C03 | 150.3° | 150.3° |
| C06 | C01 | C02 | H022 | 31.7° | 31.7° |
| C06 | C01 | C02 | H021 | 91.0° | 91.0° |
| C01 | C06 | N08 | H081 | 4.0° | 4.0° |
| O07 | C06 | C01 | N05 | 60.5° | 60.5° |
| O07 | C06 | C01 | C02 | 56.5° | 56.5° |
| O07 | C06 | C01 | H011 | 180.0° | 180.0° |
| O07 | C06 | N08 | H081 | 178.1° | 178.1° |
| N35 | S37 | O39 | C40 | 121.0° | 121.0° |
| N35 | S37 | C40 | C42 | 94.0° | 94.0° |
| N35 | S37 | C40 | C41 | 161.3° | 161.3° |
| N35 | S37 | C40 | C43 | 51.7° | 51.7° |
| O20 | C21 | N22 | C23 | 179.9° | 179.9° |
| C21 | O20 | C03 | C02 | 86.9° | 86.9° |
| C21 | O20 | C03 | C04 | 164.5° | 164.5° |
| C21 | O20 | C03 | H031 | 45.1° | 45.1° |
| N22 | C21 | O20 | C03 | 8.6° | 8.6° |
| C21 | N22 | C23 | C27 | 179.8° | 179.8° |
| N05 | C01 | C02 | H011 | 119.1° | 119.1° |
| N05 | C01 | C02 | C03 | 34.2° | 34.2° |
| C01 | N05 | C04 | C03 | 27.1° | 27.1° |
| N05 | C01 | C02 | H022 | 84.4° | 84.4° |
| N05 | C01 | C02 | H021 | 152.8° | 152.8° |
| C01 | N05 | C04 | H041 | 145.2° | 145.2° |
| C01 | N05 | C04 | H042 | 90.9° | 90.9° |
| C01 | C02 | C03 | O20 | 60.6° | 60.6° |
| C02 | C01 | N05 | C04 | 0.2° | 0.2° |
| C01 | C02 | C03 | H022 | 118.6° | 118.6° |
| C01 | C02 | C03 | H021 | 118.6° | 118.6° |
| C01 | C02 | C03 | C04 | 50.2° | 50.2° |
| C01 | C02 | H022 | H021 | 123.9° | 123.9° |
| C01 | C02 | C03 | H031 | 168.7° | 168.7° |
| C47 | C48 | C50 | H482 | 120.0° | 120.0° |
| C47 | C48 | C50 | H481 | 120.0° | 120.0° |
| C47 | C48 | C50 | C19 | 63.7° | 63.7° |
| C48 | C47 | C46 | H461 | 54.9° | 54.9° |
| C48 | C47 | H471 | H472 | 120.6° | 120.5° |
| C47 | C48 | H482 | H481 | 119.8° | 119.8° |
| C47 | C48 | C50 | H501 | 56.3° | 56.3° |
| C47 | C48 | C50 | H502 | 176.3° | 176.3° |
| C29 | C28 | C27 | C23 | 0.2° | 0.2° |
| C29 | C28 | C27 | O31 | 179.9° | 179.9° |
| C29 | C28 | O31 | C32 | 174.3° | 174.3° |
| C29 | C28 | C27 | H271 | 179.8° | 179.8° |
| C28 | C29 | C30 | H301 | 180.0° | 180.0° |
| O20 | C03 | C04 | N05 | 66.1° | 66.1° |
| O20 | C03 | C02 | C04 | 110.7° | 110.7° |
| O20 | C03 | C02 | H031 | 130.7° | 130.7° |
| O20 | C03 | C04 | H031 | 120.9° | 120.9° |
| O20 | C03 | C02 | H022 | 179.2° | 179.2° |
| O20 | C03 | C02 | H021 | 58.0° | 58.0° |
| O20 | C03 | C04 | H041 | 52.0° | 52.0° |
| O20 | C03 | C04 | H042 | 175.8° | 175.8° |
| N05 | C04 | C03 | C02 | 50.9° | 50.9° |
| N05 | C04 | C03 | H041 | 118.1° | 118.1° |
| N05 | C04 | C03 | H042 | 118.1° | 118.1° |
| C04 | N05 | C01 | H011 | 116.6° | 116.6° |
| N05 | C04 | C03 | H031 | 173.0° | 173.0° |
| N05 | C04 | H041 | H042 | 125.4° | 125.5° |
| C11 | C18 | C19 | H181 | 120.2° | 120.2° |
| C11 | C18 | C19 | H182 | 120.2° | 120.2° |
| C11 | C18 | C19 | C50 | 171.5° | 171.5° |
| C11 | C18 | H181 | H182 | 119.4° | 119.4° |
| C11 | C18 | C19 | H192 | 51.6° | 51.6° |
| C11 | C18 | C19 | H191 | 68.6° | 68.6° |
| C18 | C11 | N13 | H131 | 24.3° | 24.3° |
| N22 | C23 | C27 | C28 | 179.8° | 179.8° |
| N22 | C23 | C27 | H271 | 0.2° | 0.2° |
| C23 | C27 | C28 | H271 | 180.0° | 180.0° |
| C23 | C27 | C28 | O31 | 179.9° | 179.9° |
| O39 | S37 | C40 | C42 | 143.9° | 143.9° |
| O39 | S37 | C40 | C41 | 76.6° | 76.6° |
| O39 | S37 | C40 | C43 | 70.4° | 70.4° |
| O39 | S37 | N35 | H351 | 122.9° | 122.9° |
| S37 | C40 | C42 | C41 | 106.6° | 106.6° |
| S37 | C40 | C42 | C43 | 147.1° | 147.1° |
| S37 | C40 | C41 | C43 | 148.2° | 148.2° |
| S37 | C40 | C41 | H412 | 4.0° | 4.0° |
| S37 | C40 | C41 | H411 | 145.1° | 145.1° |
| S37 | C40 | C42 | H421 | 2.9° | 2.9° |
| S37 | C40 | C42 | H422 | 143.9° | 143.9° |
| S37 | C40 | C43 | H432 | 180.0° | 180.0° |
| S37 | C40 | C43 | H431 | 60.0° | 60.0° |
| S37 | C40 | C43 | H433 | 60.0° | 60.0° |
| C40 | S37 | N35 | H351 | 1.1° | 1.1° |
| C18 | C19 | C50 | C48 | 108.9° | 108.9° |
| C18 | C19 | C50 | H192 | 119.9° | 119.9° |
| C18 | C19 | C50 | H191 | 119.9° | 119.9° |
| C19 | C18 | C11 | H111 | 60.3° | 60.3° |
| C19 | C18 | H181 | H182 | 119.4° | 119.4° |
| C18 | C19 | H192 | H191 | 120.3° | 120.3° |
| C18 | C19 | C50 | H501 | 11.1° | 11.1° |
| C18 | C19 | C50 | H502 | 131.0° | 131.0° |
| C02 | C03 | C04 | H031 | 122.1° | 122.1° |
| C03 | C02 | C01 | H011 | 85.0° | 85.0° |
| C03 | C02 | H022 | H021 | 124.0° | 124.0° |
| C02 | C03 | C04 | H041 | 169.0° | 169.0° |
| C02 | C03 | C04 | H042 | 67.2° | 67.2° |
| C27 | C28 | O31 | C32 | 5.6° | 5.6° |
| C27 | C28 | C29 | H291 | 179.9° | 179.9° |
| O31 | C28 | C27 | H271 | 0.1° | 0.1° |
| O31 | C28 | C29 | H291 | 0.0° | 0.0° |
| C28 | O31 | C32 | H321 | 180.0° | 180.0° |
| C28 | O31 | C32 | H322 | 60.0° | 60.0° |
| C28 | O31 | C32 | H323 | 60.0° | 60.0° |
| C04 | C03 | C02 | H022 | 68.4° | 68.4° |
| C04 | C03 | C02 | H021 | 168.8° | 168.8° |
| C03 | C04 | H041 | H042 | 125.4° | 125.4° |
| C40 | C42 | C41 | H421 | 109.4° | 109.4° |
| C40 | C42 | C41 | H422 | 109.5° | 109.5° |
| C42 | C40 | C41 | C43 | 106.3° | 106.3° |
| C40 | C42 | C41 | H412 | 109.5° | 109.5° |
| C40 | C42 | C41 | H411 | 109.5° | 109.4° |
| C40 | C42 | H421 | H422 | 144.7° | 144.7° |
| C42 | C40 | C43 | H432 | 34.5° | 34.5° |
| C42 | C40 | C43 | H431 | 85.5° | 85.5° |
| C42 | C40 | C43 | H433 | 154.5° | 154.5° |
| C42 | C41 | H412 | H411 | 144.8° | 144.8° |
| C41 | C42 | H421 | H422 | 144.8° | 144.8° |
| C48 | C50 | C19 | H501 | 120.0° | 120.0° |
| C48 | C50 | C19 | H502 | 120.0° | 120.0° |
| C48 | C50 | C19 | H192 | 10.9° | 10.9° |
| C48 | C50 | C19 | H191 | 131.2° | 131.2° |
| C50 | C48 | C47 | H471 | 69.4° | 69.4° |
| C50 | C48 | C47 | H472 | 51.0° | 51.0° |
| C50 | C48 | H482 | H481 | 119.8° | 119.8° |
| C48 | C50 | H501 | H502 | 119.9° | 119.9° |
| C40 | C41 | H412 | H411 | 144.8° | 144.7° |
| C41 | C40 | C43 | H432 | 33.1° | 33.1° |
| C41 | C40 | C43 | H431 | 153.1° | 153.1° |
| C41 | C40 | C43 | H433 | 86.9° | 86.9° |
| C43 | C40 | C41 | H412 | 144.2° | 144.2° |
| C43 | C40 | C41 | H411 | 3.1° | 3.1° |
| C43 | C40 | C42 | H421 | 144.2° | 144.2° |
| C43 | C40 | C42 | H422 | 3.2° | 3.2° |
| C40 | C43 | H432 | H431 | 120.0° | 120.0° |
| C40 | C43 | H432 | H433 | 120.0° | 120.0° |
| C40 | C43 | H431 | H433 | 120.0° | 120.0° |
| C50 | C19 | C18 | H181 | 68.3° | 68.3° |
| C50 | C19 | C18 | H182 | 51.3° | 51.3° |
| C50 | C19 | H192 | H191 | 120.4° | 120.4° |
| C19 | C50 | C48 | H482 | 176.2° | 176.2° |
| C19 | C50 | C48 | H481 | 56.3° | 56.3° |
| C19 | C50 | H501 | H502 | 119.9° | 119.9° |
| O31 | C32 | H321 | H322 | 120.0° | 120.0° |
| O31 | C32 | H321 | H323 | 120.0° | 120.0° |
| O31 | C32 | H322 | H323 | 120.0° | 120.0° |
| H011 | C01 | C02 | H022 | 156.4° | 156.4° |
| H011 | C01 | C02 | H021 | 33.7° | 33.7° |
| H022 | C02 | C03 | H031 | 50.2° | 50.2° |
| H021 | C02 | C03 | H031 | 72.6° | 72.6° |
| H031 | C03 | C04 | H041 | 68.9° | 68.9° |
| H031 | C03 | C04 | H042 | 55.0° | 55.0° |
| H111 | C11 | C18 | H181 | 59.9° | 59.9° |
| H111 | C11 | C18 | H182 | 179.5° | 179.5° |
| H111 | C11 | N13 | H131 | 144.6° | 144.6° |
| H181 | C18 | C19 | H192 | 171.8° | 171.8° |
| H181 | C18 | C19 | H191 | 51.6° | 51.6° |
| H182 | C18 | C19 | H192 | 68.5° | 68.5° |
| H182 | C18 | C19 | H191 | 171.2° | 171.2° |
| H192 | C19 | C50 | H501 | 131.0° | 131.0° |
| H192 | C19 | C50 | H502 | 109.1° | 109.1° |
| H191 | C19 | C50 | H501 | 108.8° | 108.8° |
| H191 | C19 | C50 | H502 | 11.1° | 11.1° |
| H291 | C29 | C30 | H301 | 0.0° | 0.0° |
| H321 | C32 | H322 | H323 | 120.0° | 120.0° |
| H333 | C33 | H332 | H331 | 120.0° | 120.0° |
| H412 | C41 | C42 | H421 | 0.0° | 0.0° |
| H412 | C41 | C42 | H422 | 141.1° | 141.1° |
| H411 | C41 | C42 | H421 | 141.1° | 141.1° |
| H411 | C41 | C42 | H422 | 0.0° | 0.1° |
| H432 | C43 | H431 | H433 | 120.0° | 120.0° |
| H441 | C44 | C45 | H451 | 141.3° | 141.3° |
| H441 | C44 | C49 | H491 | 148.5° | 148.5° |
| H441 | C44 | C49 | H492 | 7.6° | 7.6° |
| H451 | C45 | C46 | H461 | 0.2° | 0.2° |
| H461 | C46 | C47 | H471 | 174.7° | 174.7° |
| H461 | C46 | C47 | H472 | 65.0° | 64.9° |
| H471 | C47 | C48 | H482 | 170.5° | 170.5° |
| H471 | C47 | C48 | H481 | 50.7° | 50.7° |
| H472 | C47 | C48 | H482 | 69.1° | 69.1° |
| H472 | C47 | C48 | H481 | 171.0° | 171.0° |
| H482 | C48 | C50 | H501 | 63.7° | 63.7° |
| H482 | C48 | C50 | H502 | 56.2° | 56.2° |
| H481 | C48 | C50 | H501 | 176.4° | 176.4° |
| H481 | C48 | C50 | H502 | 63.7° | 63.7° |
| H522 | C52 | C53 | H532 | 141.1° | 141.1° |
| H522 | C52 | C53 | H531 | 0.1° | 0.1° |
| H521 | C52 | C53 | H532 | 0.0° | 0.0° |
| H521 | C52 | C53 | H531 | 141.1° | 141.1° |
