A1IR6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | O01 | sing | 1.43Å | 1.39Å | |
| O04 | C03 | sing | 1.43Å | 1.40Å | |
| C05 | C03 | sing | 1.53Å | 1.53Å | |
| O06 | C05 | sing | 1.43Å | 1.39Å | |
| C07 | C05 | sing | 1.53Å | 1.53Å | |
| O08 | C07 | sing | 1.43Å | 1.40Å | |
| P09 | O08 | sing | 1.61Å | 1.65Å | |
| C11 | O10 | sing | 1.43Å | 1.41Å | |
| C12 | C11 | sing | 1.53Å | 1.54Å | |
| O13 | C12 | sing | 1.43Å | 1.39Å | |
| C14 | C12 | sing | 1.53Å | 1.53Å | |
| O15 | C14 | sing | 1.43Å | 1.39Å | |
| C16 | C14 | sing | 1.53Å | 1.54Å | |
| O17 | C16 | sing | 1.43Å | 1.39Å | |
| C18 | C16 | sing | 1.53Å | 1.53Å | |
| O19 | C18 | sing | 1.43Å | 1.42Å | |
| P20 | O19 | sing | 1.61Å | 1.67Å | |
| C22 | O21 | sing | 1.43Å | 1.43Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| O24 | C23 | sing | 1.43Å | 1.40Å | |
| C25 | C23 | sing | 1.53Å | 1.53Å | |
| O26 | C25 | sing | 1.43Å | 1.40Å | |
| C27 | C25 | sing | 1.53Å | 1.53Å | |
| O28 | C27 | sing | 1.43Å | 1.40Å | |
| C29 | C27 | sing | 1.53Å | 1.54Å | |
| O30 | C29 | sing | 1.43Å | 1.42Å | |
| P31 | O30 | sing | 1.61Å | 1.66Å | |
| C33 | O32 | sing | 1.43Å | 1.41Å | |
| C34 | C33 | sing | 1.53Å | 1.54Å | |
| C35 | C34 | sing | 1.53Å | 1.54Å | |
| C36 | C35 | sing | 1.53Å | 1.54Å | |
| C37 | C36 | sing | 1.53Å | 1.54Å | |
| C38 | C37 | sing | 1.53Å | 1.53Å | |
| N39 | C38 | sing | 1.47Å | 1.45Å | |
| O32 | P31 | sing | 1.61Å | 1.66Å | |
| O40 | P31 | doub | 1.48Å | 1.51Å | |
| O41 | P31 | sing | 1.61Å | 1.51Å | |
| O21 | P20 | sing | 1.61Å | 1.68Å | |
| O42 | P20 | sing | 1.61Å | 1.51Å | |
| O43 | P20 | doub | 1.48Å | 1.51Å | |
| O10 | P09 | sing | 1.61Å | 1.66Å | |
| O44 | P09 | doub | 1.48Å | 1.51Å | |
| O45 | P09 | sing | 1.61Å | 1.51Å | |
| C03 | C02 | sing | 1.53Å | 1.53Å | |
| C46 | C02 | sing | 1.53Å | 1.54Å | |
| O47 | C46 | sing | 1.43Å | 1.42Å | |
| P48 | O47 | sing | 1.61Å | 1.67Å | |
| C50 | O49 | sing | 1.43Å | 1.42Å | |
| C51 | C50 | sing | 1.53Å | 1.54Å | |
| O52 | C51 | sing | 1.43Å | 1.39Å | |
| C53 | C51 | sing | 1.53Å | 1.53Å | |
| O54 | C53 | sing | 1.43Å | 1.40Å | |
| C55 | C53 | sing | 1.53Å | 1.53Å | |
| O56 | C55 | sing | 1.43Å | 1.40Å | |
| C57 | C55 | sing | 1.53Å | 1.53Å | |
| O58 | C57 | sing | 1.43Å | 1.40Å | |
| O49 | P48 | sing | 1.61Å | 1.67Å | |
| O59 | P48 | doub | 1.48Å | 1.51Å | |
| O60 | P48 | sing | 1.61Å | 1.51Å | |
| H021 | C02 | sing | 1.09Å | 1.10Å | |
| H031 | C03 | sing | 1.09Å | 1.10Å | |
| H051 | C05 | sing | 1.09Å | 1.10Å | |
| H121 | C12 | sing | 1.09Å | 1.10Å | |
| H141 | C14 | sing | 1.09Å | 1.10Å | |
| H161 | C16 | sing | 1.09Å | 1.10Å | |
| H231 | C23 | sing | 1.09Å | 1.10Å | |
| H251 | C25 | sing | 1.09Å | 1.10Å | |
| H271 | C27 | sing | 1.09Å | 1.10Å | |
| H511 | C51 | sing | 1.09Å | 1.10Å | |
| H531 | C53 | sing | 1.09Å | 1.10Å | |
| H551 | C55 | sing | 1.09Å | 1.10Å | |
| H011 | O01 | sing | 0.97Å | 0.95Å | |
| H041 | O04 | sing | 0.97Å | 0.95Å | |
| H061 | O06 | sing | 0.97Å | 0.95Å | |
| H071 | C07 | sing | 1.09Å | 1.10Å | |
| H072 | C07 | sing | 1.09Å | 1.10Å | |
| H111 | C11 | sing | 1.09Å | 1.10Å | |
| H112 | C11 | sing | 1.09Å | 1.10Å | |
| H131 | O13 | sing | 0.97Å | 0.95Å | |
| H151 | O15 | sing | 0.97Å | 0.95Å | |
| H171 | O17 | sing | 0.97Å | 0.95Å | |
| H181 | C18 | sing | 1.09Å | 1.10Å | |
| H182 | C18 | sing | 1.09Å | 1.10Å | |
| H221 | C22 | sing | 1.09Å | 1.10Å | |
| H222 | C22 | sing | 1.09Å | 1.10Å | |
| H241 | O24 | sing | 0.97Å | 0.95Å | |
| H261 | O26 | sing | 0.97Å | 0.95Å | |
| H281 | O28 | sing | 0.97Å | 0.95Å | |
| H291 | C29 | sing | 1.09Å | 1.10Å | |
| H292 | C29 | sing | 1.09Å | 1.10Å | |
| H331 | C33 | sing | 1.09Å | 1.10Å | |
| H332 | C33 | sing | 1.09Å | 1.10Å | |
| H341 | C34 | sing | 1.09Å | 1.10Å | |
| H342 | C34 | sing | 1.09Å | 1.10Å | |
| H351 | C35 | sing | 1.09Å | 1.10Å | |
| H352 | C35 | sing | 1.09Å | 1.10Å | |
| H361 | C36 | sing | 1.09Å | 1.10Å | |
| H362 | C36 | sing | 1.09Å | 1.10Å | |
| H371 | C37 | sing | 1.09Å | 1.10Å | |
| H372 | C37 | sing | 1.09Å | 1.10Å | |
| H381 | C38 | sing | 1.09Å | 1.10Å | |
| H382 | C38 | sing | 1.09Å | 1.10Å | |
| H391 | N39 | sing | 1.01Å | 1.00Å | |
| H392 | N39 | sing | 1.01Å | 1.00Å | |
| H461 | C46 | sing | 1.09Å | 1.10Å | |
| H462 | C46 | sing | 1.09Å | 1.10Å | |
| H501 | C50 | sing | 1.09Å | 1.10Å | |
| H502 | C50 | sing | 1.09Å | 1.10Å | |
| H521 | O52 | sing | 0.97Å | 0.95Å | |
| H541 | O54 | sing | 0.97Å | 0.95Å | |
| H561 | O56 | sing | 0.97Å | 0.95Å | |
| H571 | C57 | sing | 1.09Å | 1.10Å | |
| H572 | C57 | sing | 1.09Å | 1.10Å | |
| H581 | O58 | sing | 0.97Å | 0.95Å | |
| O41 | H2 | sing | 0.97Å | 0.95Å | |
| O42 | H3 | sing | 0.97Å | 0.95Å | |
| O45 | H4 | sing | 0.97Å | 0.95Å | |
| O60 | H5 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C02 | C03 | 109.5° | 109.5° |
| O01 | C02 | C46 | 109.5° | 109.5° |
| O01 | C02 | H021 | 110.8° | 109.5° |
| C02 | O01 | H011 | 109.5° | 114.0° |
| O04 | C03 | C05 | 109.5° | 109.5° |
| O04 | C03 | C02 | 109.5° | 109.5° |
| O04 | C03 | H031 | 110.7° | 109.5° |
| C03 | O04 | H041 | 109.5° | 114.0° |
| C03 | C05 | O06 | 109.5° | 109.5° |
| C03 | C05 | C07 | 109.5° | 109.4° |
| C05 | C03 | C02 | 109.5° | 109.4° |
| C05 | C03 | H031 | 108.8° | 109.4° |
| C03 | C05 | H051 | 108.8° | 109.5° |
| O06 | C05 | C07 | 109.4° | 109.5° |
| O06 | C05 | H051 | 110.8° | 109.5° |
| C05 | O06 | H061 | 109.5° | 114.0° |
| C05 | C07 | O08 | 108.4° | 109.5° |
| C07 | C05 | H051 | 108.8° | 109.4° |
| C05 | C07 | H071 | 109.8° | 109.5° |
| C05 | C07 | H072 | 109.8° | 109.4° |
| C07 | O08 | P09 | 118.4° | 123.0° |
| O08 | C07 | H071 | 109.7° | 109.5° |
| O08 | C07 | H072 | 109.7° | 109.4° |
| O08 | P09 | O10 | 109.5° | 109.5° |
| O08 | P09 | O44 | 109.5° | 109.5° |
| O08 | P09 | O45 | 109.5° | 109.5° |
| O10 | C11 | C12 | 108.3° | 109.5° |
| C11 | O10 | P09 | 118.5° | 123.0° |
| O10 | C11 | H111 | 109.8° | 109.5° |
| O10 | C11 | H112 | 109.8° | 109.5° |
| C11 | C12 | O13 | 109.5° | 109.4° |
| C11 | C12 | C14 | 109.5° | 109.4° |
| C11 | C12 | H121 | 108.7° | 109.5° |
| C12 | C11 | H111 | 109.8° | 109.5° |
| C12 | C11 | H112 | 109.7° | 109.4° |
| O13 | C12 | C14 | 109.4° | 109.5° |
| O13 | C12 | H121 | 110.9° | 109.5° |
| C12 | O13 | H131 | 109.5° | 114.0° |
| C12 | C14 | O15 | 109.4° | 109.5° |
| C12 | C14 | C16 | 109.5° | 109.4° |
| C14 | C12 | H121 | 108.8° | 109.5° |
| C12 | C14 | H141 | 108.8° | 109.5° |
| O15 | C14 | C16 | 109.5° | 109.4° |
| O15 | C14 | H141 | 110.8° | 109.5° |
| C14 | O15 | H151 | 109.5° | 114.0° |
| C14 | C16 | O17 | 109.5° | 109.5° |
| C14 | C16 | C18 | 109.5° | 109.5° |
| C16 | C14 | H141 | 108.8° | 109.5° |
| C14 | C16 | H161 | 108.8° | 109.5° |
| O17 | C16 | C18 | 109.5° | 109.5° |
| O17 | C16 | H161 | 110.7° | 109.5° |
| C16 | O17 | H171 | 109.5° | 114.0° |
| C16 | C18 | O19 | 108.4° | 109.5° |
| C18 | C16 | H161 | 108.9° | 109.4° |
| C16 | C18 | H181 | 109.7° | 109.5° |
| C16 | C18 | H182 | 109.7° | 109.4° |
| C18 | O19 | P20 | 118.4° | 123.0° |
| O19 | C18 | H181 | 109.7° | 109.5° |
| O19 | C18 | H182 | 109.7° | 109.5° |
| O19 | P20 | O21 | 109.5° | 109.5° |
| O19 | P20 | O42 | 109.5° | 109.5° |
| O19 | P20 | O43 | 109.5° | 109.5° |
| O21 | C22 | C23 | 108.4° | 109.5° |
| C22 | O21 | P20 | 118.5° | 123.0° |
| O21 | C22 | H221 | 109.7° | 109.5° |
| O21 | C22 | H222 | 109.7° | 109.5° |
| C22 | C23 | O24 | 109.4° | 109.5° |
| C22 | C23 | C25 | 109.5° | 109.5° |
| C22 | C23 | H231 | 108.7° | 109.5° |
| C23 | C22 | H221 | 109.7° | 109.4° |
| C23 | C22 | H222 | 109.8° | 109.5° |
| O24 | C23 | C25 | 109.5° | 109.5° |
| O24 | C23 | H231 | 110.7° | 109.4° |
| C23 | O24 | H241 | 109.5° | 114.0° |
| C23 | C25 | O26 | 109.5° | 109.5° |
| C23 | C25 | C27 | 109.5° | 109.5° |
| C25 | C23 | H231 | 108.9° | 109.5° |
| C23 | C25 | H251 | 108.9° | 109.5° |
| O26 | C25 | C27 | 109.5° | 109.5° |
| O26 | C25 | H251 | 110.6° | 109.5° |
| C25 | O26 | H261 | 109.5° | 114.1° |
| C25 | C27 | O28 | 109.5° | 109.5° |
| C25 | C27 | C29 | 109.5° | 109.4° |
| C27 | C25 | H251 | 108.9° | 109.4° |
| C25 | C27 | H271 | 108.9° | 109.4° |
| O28 | C27 | C29 | 109.5° | 109.5° |
| O28 | C27 | H271 | 110.7° | 109.5° |
| C27 | O28 | H281 | 109.5° | 114.0° |
| C27 | C29 | O30 | 108.3° | 109.4° |
| C29 | C27 | H271 | 108.7° | 109.5° |
| C27 | C29 | H291 | 109.7° | 109.5° |
| C27 | C29 | H292 | 109.7° | 109.5° |
| C29 | O30 | P31 | 118.5° | 123.0° |
| O30 | C29 | H291 | 109.8° | 109.5° |
| O30 | C29 | H292 | 109.8° | 109.5° |
| O30 | P31 | O32 | 109.5° | 109.4° |
| O30 | P31 | O40 | 109.5° | 109.4° |
| O30 | P31 | O41 | 109.5° | 109.5° |
| O32 | C33 | C34 | 108.4° | 109.5° |
| C33 | O32 | P31 | 118.5° | 123.0° |
| O32 | C33 | H331 | 109.8° | 109.5° |
| O32 | C33 | H332 | 109.8° | 109.5° |
| C33 | C34 | C35 | 112.3° | 109.4° |
| C34 | C33 | H331 | 109.7° | 109.5° |
| C34 | C33 | H332 | 109.8° | 109.5° |
| C33 | C34 | H341 | 108.8° | 109.5° |
| C33 | C34 | H342 | 108.8° | 109.5° |
| C34 | C35 | C36 | 112.3° | 109.4° |
| C35 | C34 | H341 | 108.7° | 109.5° |
| C35 | C34 | H342 | 108.8° | 109.5° |
| C34 | C35 | H351 | 108.8° | 109.5° |
| C34 | C35 | H352 | 108.8° | 109.5° |
| C35 | C36 | C37 | 112.3° | 109.4° |
| C36 | C35 | H351 | 108.8° | 109.5° |
| C36 | C35 | H352 | 108.8° | 109.5° |
| C35 | C36 | H361 | 108.8° | 109.5° |
| C35 | C36 | H362 | 108.8° | 109.5° |
| C36 | C37 | C38 | 112.3° | 109.4° |
| C37 | C36 | H361 | 108.7° | 109.5° |
| C37 | C36 | H362 | 108.7° | 109.5° |
| C36 | C37 | H371 | 108.7° | 109.5° |
| C36 | C37 | H372 | 108.7° | 109.5° |
| C37 | C38 | N39 | 110.4° | 109.4° |
| C38 | C37 | H371 | 108.8° | 109.5° |
| C38 | C37 | H372 | 108.8° | 109.4° |
| C37 | C38 | H381 | 109.3° | 109.5° |
| C37 | C38 | H382 | 109.3° | 109.5° |
| N39 | C38 | H381 | 109.2° | 109.5° |
| N39 | C38 | H382 | 109.2° | 109.5° |
| C38 | N39 | H391 | 109.5° | 111.0° |
| C38 | N39 | H392 | 109.5° | 111.0° |
| O32 | P31 | O40 | 109.5° | 109.5° |
| O32 | P31 | O41 | 109.5° | 109.5° |
| O40 | P31 | O41 | 109.5° | 109.5° |
| P31 | O41 | H2 | 109.5° | 114.0° |
| O21 | P20 | O42 | 109.5° | 109.5° |
| O21 | P20 | O43 | 109.4° | 109.5° |
| O42 | P20 | O43 | 109.5° | 109.5° |
| P20 | O42 | H3 | 109.5° | 114.0° |
| O10 | P09 | O44 | 109.4° | 109.5° |
| O10 | P09 | O45 | 109.5° | 109.5° |
| O44 | P09 | O45 | 109.5° | 109.5° |
| P09 | O45 | H4 | 109.5° | 114.0° |
| C03 | C02 | C46 | 109.5° | 109.4° |
| C03 | C02 | H021 | 108.9° | 109.5° |
| C02 | C03 | H031 | 108.9° | 109.5° |
| C02 | C46 | O47 | 108.3° | 109.4° |
| C46 | C02 | H021 | 108.7° | 109.5° |
| C02 | C46 | H461 | 109.8° | 109.5° |
| C02 | C46 | H462 | 109.8° | 109.4° |
| C46 | O47 | P48 | 118.4° | 123.0° |
| O47 | C46 | H461 | 109.8° | 109.5° |
| O47 | C46 | H462 | 109.7° | 109.4° |
| O47 | P48 | O49 | 109.5° | 109.4° |
| O47 | P48 | O59 | 109.5° | 109.4° |
| O47 | P48 | O60 | 109.5° | 109.5° |
| O49 | C50 | C51 | 108.4° | 109.5° |
| C50 | O49 | P48 | 118.5° | 123.0° |
| O49 | C50 | H501 | 109.7° | 109.5° |
| O49 | C50 | H502 | 109.8° | 109.5° |
| C50 | C51 | O52 | 109.5° | 109.4° |
| C50 | C51 | C53 | 109.5° | 109.5° |
| C50 | C51 | H511 | 108.7° | 109.4° |
| C51 | C50 | H501 | 109.7° | 109.5° |
| C51 | C50 | H502 | 109.7° | 109.4° |
| O52 | C51 | C53 | 109.5° | 109.5° |
| O52 | C51 | H511 | 110.8° | 109.5° |
| C51 | O52 | H521 | 109.5° | 114.0° |
| C51 | C53 | O54 | 109.5° | 109.5° |
| C51 | C53 | C55 | 109.5° | 109.5° |
| C53 | C51 | H511 | 108.9° | 109.5° |
| C51 | C53 | H531 | 108.8° | 109.4° |
| O54 | C53 | C55 | 109.5° | 109.5° |
| O54 | C53 | H531 | 110.6° | 109.4° |
| C53 | O54 | H541 | 109.5° | 114.0° |
| C53 | C55 | O56 | 109.5° | 109.5° |
| C53 | C55 | C57 | 109.5° | 109.5° |
| C55 | C53 | H531 | 108.9° | 109.5° |
| C53 | C55 | H551 | 108.9° | 109.5° |
| O56 | C55 | C57 | 109.5° | 109.4° |
| O56 | C55 | H551 | 110.6° | 109.4° |
| C55 | O56 | H561 | 109.5° | 114.0° |
| C55 | C57 | O58 | 108.3° | 109.5° |
| C57 | C55 | H551 | 108.9° | 109.5° |
| C55 | C57 | H571 | 109.8° | 109.5° |
| C55 | C57 | H572 | 109.7° | 109.5° |
| O58 | C57 | H571 | 109.8° | 109.4° |
| O58 | C57 | H572 | 109.8° | 109.5° |
| C57 | O58 | H581 | 109.5° | 114.0° |
| O49 | P48 | O59 | 109.5° | 109.5° |
| O49 | P48 | O60 | 109.4° | 109.5° |
| O59 | P48 | O60 | 109.4° | 109.5° |
| P48 | O60 | H5 | 109.5° | 114.0° |
| H071 | C07 | H072 | 109.5° | 109.5° |
| H111 | C11 | H112 | 109.5° | 109.5° |
| H181 | C18 | H182 | 109.5° | 109.4° |
| H221 | C22 | H222 | 109.5° | 109.4° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H331 | C33 | H332 | 109.5° | 109.5° |
| H341 | C34 | H342 | 109.5° | 109.5° |
| H351 | C35 | H352 | 109.5° | 109.5° |
| H361 | C36 | H362 | 109.5° | 109.5° |
| H371 | C37 | H372 | 109.5° | 109.5° |
| H381 | C38 | H382 | 109.4° | 109.5° |
| H391 | N39 | H392 | 109.4° | 111.0° |
| H461 | C46 | H462 | 109.5° | 109.5° |
| H501 | C50 | H502 | 109.5° | 109.4° |
| H571 | C57 | H572 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C02 | C03 | O04 | 162.0° | 180.0° |
| O01 | C02 | C03 | C05 | 78.0° | 60.0° |
| O01 | C02 | C03 | C46 | 120.0° | 120.0° |
| O01 | C02 | C03 | H021 | 121.3° | 120.0° |
| O01 | C02 | C46 | H021 | 121.2° | 120.0° |
| O01 | C02 | C46 | O47 | 35.2° | 65.0° |
| O01 | C02 | C03 | H031 | 40.8° | 60.0° |
| O01 | C02 | C46 | H461 | 155.0° | 55.0° |
| O01 | C02 | C46 | H462 | 84.6° | 175.1° |
| O04 | C03 | C05 | C02 | 120.0° | 120.0° |
| O04 | C03 | C05 | H031 | 121.1° | 120.0° |
| O04 | C03 | C05 | O06 | 109.8° | 180.0° |
| O04 | C03 | C05 | C07 | 130.2° | 60.0° |
| O04 | C03 | C02 | H031 | 121.2° | 120.1° |
| O04 | C03 | C02 | C46 | 42.0° | 60.0° |
| O04 | C03 | C02 | H021 | 76.7° | 60.0° |
| O04 | C03 | C05 | H051 | 11.4° | 59.9° |
| C03 | C05 | O06 | C07 | 120.0° | 120.0° |
| C03 | C05 | O06 | H051 | 120.0° | 120.0° |
| C03 | C05 | C07 | H051 | 118.7° | 120.0° |
| C03 | C05 | C07 | O08 | 83.9° | 175.0° |
| C05 | C03 | C02 | H031 | 118.8° | 119.9° |
| C05 | C03 | C02 | C46 | 162.0° | 180.0° |
| C05 | C03 | C02 | H021 | 43.3° | 60.0° |
| C05 | C03 | O04 | H041 | 180.0° | 60.0° |
| C03 | C05 | O06 | H061 | 180.0° | 60.0° |
| C03 | C05 | C07 | H071 | 36.0° | 55.0° |
| C03 | C05 | C07 | H072 | 156.3° | 65.0° |
| O06 | C05 | C07 | H051 | 121.2° | 120.0° |
| O06 | C05 | C07 | O08 | 156.1° | 65.0° |
| O06 | C05 | C03 | C02 | 10.2° | 60.0° |
| O06 | C05 | C03 | H031 | 129.1° | 60.0° |
| O06 | C05 | C07 | H071 | 84.1° | 175.0° |
| O06 | C05 | C07 | H072 | 36.3° | 55.0° |
| C05 | C07 | O08 | H071 | 119.8° | 120.0° |
| C05 | C07 | O08 | H072 | 119.8° | 119.9° |
| C05 | C07 | O08 | P09 | 156.2° | 180.0° |
| C07 | C05 | C03 | C02 | 109.8° | 180.0° |
| C07 | C05 | C03 | H031 | 9.1° | 60.1° |
| C07 | C05 | O06 | H061 | 60.0° | 60.0° |
| C05 | C07 | H071 | H072 | 120.5° | 120.0° |
| C07 | O08 | P09 | O10 | 126.8° | 175.0° |
| C07 | O08 | P09 | O44 | 6.8° | 55.0° |
| C07 | O08 | P09 | O45 | 113.3° | 65.0° |
| O08 | C07 | C05 | H051 | 34.9° | 55.1° |
| O08 | C07 | H071 | H072 | 120.5° | 120.0° |
| O08 | P09 | O10 | C11 | 169.7° | 175.0° |
| O08 | P09 | O10 | O44 | 120.0° | 120.0° |
| O08 | P09 | O10 | O45 | 120.0° | 120.0° |
| O08 | P09 | O44 | O45 | 120.0° | 120.0° |
| P09 | O08 | C07 | H071 | 84.0° | 60.0° |
| P09 | O08 | C07 | H072 | 36.3° | 60.0° |
| O08 | P09 | O45 | H4 | 120.1° | 60.0° |
| O10 | C11 | C12 | H111 | 119.8° | 120.0° |
| O10 | C11 | C12 | H112 | 119.8° | 120.0° |
| O10 | C11 | C12 | O13 | 57.9° | 65.0° |
| O10 | C11 | C12 | C14 | 177.8° | 175.0° |
| C11 | O10 | P09 | O44 | 49.6° | 55.0° |
| C11 | O10 | P09 | O45 | 70.4° | 65.0° |
| O10 | C11 | C12 | H121 | 63.4° | 55.0° |
| O10 | C11 | H111 | H112 | 120.5° | 120.0° |
| C11 | C12 | O13 | C14 | 120.0° | 119.9° |
| C11 | C12 | O13 | H121 | 119.9° | 120.0° |
| C11 | C12 | C14 | H121 | 118.7° | 120.0° |
| C11 | C12 | C14 | O15 | 15.6° | 60.0° |
| C11 | C12 | C14 | C16 | 135.6° | 180.0° |
| C12 | C11 | O10 | P09 | 169.7° | 180.0° |
| C11 | C12 | C14 | H141 | 105.6° | 60.0° |
| C12 | C11 | H111 | H112 | 120.5° | 120.0° |
| C11 | C12 | O13 | H131 | 180.0° | 60.0° |
| O13 | C12 | C14 | H121 | 121.3° | 120.1° |
| O13 | C12 | C14 | O15 | 135.6° | 180.0° |
| O13 | C12 | C14 | C16 | 104.4° | 60.1° |
| O13 | C12 | C14 | H141 | 14.4° | 59.9° |
| O13 | C12 | C11 | H111 | 177.7° | 175.0° |
| O13 | C12 | C11 | H112 | 61.9° | 55.0° |
| C12 | C14 | O15 | C16 | 120.0° | 120.0° |
| C12 | C14 | O15 | H141 | 120.0° | 120.1° |
| C12 | C14 | C16 | H141 | 118.8° | 120.0° |
| C12 | C14 | C16 | O17 | 49.5° | 60.0° |
| C12 | C14 | C16 | C18 | 70.6° | 179.9° |
| C12 | C14 | C16 | H161 | 170.6° | 60.0° |
| C14 | C12 | C11 | H111 | 62.3° | 55.0° |
| C14 | C12 | C11 | H112 | 58.0° | 65.0° |
| C14 | C12 | O13 | H131 | 60.0° | 59.9° |
| C12 | C14 | O15 | H151 | 180.0° | 59.9° |
| O15 | C14 | C16 | H141 | 121.2° | 120.0° |
| O15 | C14 | C16 | O17 | 70.5° | 180.0° |
| O15 | C14 | C16 | C18 | 169.5° | 60.0° |
| O15 | C14 | C12 | H121 | 103.1° | 59.9° |
| O15 | C14 | C16 | H161 | 50.6° | 60.0° |
| C14 | C16 | O17 | C18 | 120.0° | 120.0° |
| C14 | C16 | O17 | H161 | 119.9° | 120.0° |
| C14 | C16 | C18 | H161 | 118.8° | 120.0° |
| C14 | C16 | C18 | O19 | 170.8° | 175.0° |
| C16 | C14 | C12 | H121 | 16.9° | 60.0° |
| C16 | C14 | O15 | H151 | 60.0° | 60.0° |
| C14 | C16 | O17 | H171 | 180.0° | 60.0° |
| C14 | C16 | C18 | H181 | 51.0° | 54.9° |
| C14 | C16 | C18 | H182 | 69.3° | 65.0° |
| O17 | C16 | C18 | H161 | 121.2° | 120.0° |
| O17 | C16 | C18 | O19 | 69.1° | 64.9° |
| O17 | C16 | C14 | H141 | 168.3° | 60.0° |
| O17 | C16 | C18 | H181 | 171.1° | 175.0° |
| O17 | C16 | C18 | H182 | 50.7° | 55.0° |
| C16 | C18 | O19 | H181 | 119.8° | 120.0° |
| C16 | C18 | O19 | H182 | 119.8° | 120.0° |
| C16 | C18 | O19 | P20 | 157.9° | 180.0° |
| C18 | C16 | C14 | H141 | 48.3° | 60.0° |
| C18 | C16 | O17 | H171 | 60.0° | 60.1° |
| C16 | C18 | H181 | H182 | 120.5° | 119.9° |
| C18 | O19 | P20 | O21 | 148.4° | 175.0° |
| C18 | O19 | P20 | O42 | 91.6° | 65.0° |
| C18 | O19 | P20 | O43 | 28.5° | 55.0° |
| O19 | C18 | C16 | H161 | 52.1° | 55.1° |
| O19 | C18 | H181 | H182 | 120.5° | 120.0° |
| O19 | P20 | O21 | C22 | 172.7° | 175.0° |
| O19 | P20 | O21 | O42 | 120.0° | 120.0° |
| O19 | P20 | O21 | O43 | 120.0° | 120.0° |
| O19 | P20 | O42 | O43 | 120.0° | 120.0° |
| P20 | O19 | C18 | H181 | 82.3° | 60.0° |
| P20 | O19 | C18 | H182 | 38.1° | 60.0° |
| O19 | P20 | O42 | H3 | 120.0° | 60.0° |
| O21 | C22 | C23 | H221 | 119.8° | 120.0° |
| O21 | C22 | C23 | H222 | 119.8° | 120.1° |
| O21 | C22 | C23 | O24 | 91.6° | 65.0° |
| O21 | C22 | C23 | C25 | 148.3° | 175.0° |
| C22 | O21 | P20 | O42 | 67.3° | 65.0° |
| C22 | O21 | P20 | O43 | 52.7° | 55.0° |
| O21 | C22 | C23 | H231 | 29.4° | 55.0° |
| O21 | C22 | H221 | H222 | 120.5° | 120.0° |
| C22 | C23 | O24 | C25 | 120.1° | 120.0° |
| C22 | C23 | O24 | H231 | 119.9° | 120.0° |
| C22 | C23 | C25 | H231 | 118.8° | 120.0° |
| C22 | C23 | C25 | O26 | 53.6° | 60.0° |
| C22 | C23 | C25 | C27 | 173.6° | 180.0° |
| C23 | C22 | O21 | P20 | 170.8° | 180.0° |
| C22 | C23 | C25 | H251 | 67.5° | 60.0° |
| C23 | C22 | H221 | H222 | 120.5° | 119.9° |
| C22 | C23 | O24 | H241 | 180.0° | 60.0° |
| O24 | C23 | C25 | H231 | 121.2° | 120.0° |
| O24 | C23 | C25 | O26 | 173.6° | 180.0° |
| O24 | C23 | C25 | C27 | 66.4° | 60.0° |
| O24 | C23 | C25 | H251 | 52.5° | 60.0° |
| O24 | C23 | C22 | H221 | 148.5° | 175.0° |
| O24 | C23 | C22 | H222 | 28.2° | 55.1° |
| C23 | C25 | O26 | C27 | 120.0° | 120.0° |
| C23 | C25 | O26 | H251 | 120.0° | 120.0° |
| C23 | C25 | C27 | H251 | 118.9° | 120.0° |
| C23 | C25 | C27 | O28 | 137.7° | 60.0° |
| C23 | C25 | C27 | C29 | 102.2° | 180.0° |
| C23 | C25 | C27 | H271 | 16.5° | 60.0° |
| C25 | C23 | C22 | H221 | 28.5° | 55.0° |
| C25 | C23 | C22 | H222 | 91.9° | 65.0° |
| C25 | C23 | O24 | H241 | 59.9° | 60.0° |
| C23 | C25 | O26 | H261 | 180.0° | 60.0° |
| O26 | C25 | C27 | H251 | 121.1° | 120.0° |
| O26 | C25 | C27 | O28 | 102.3° | 180.0° |
| O26 | C25 | C27 | C29 | 17.8° | 60.0° |
| O26 | C25 | C23 | H231 | 65.2° | 60.0° |
| O26 | C25 | C27 | H271 | 136.6° | 60.0° |
| C25 | C27 | O28 | C29 | 120.1° | 120.0° |
| C25 | C27 | O28 | H271 | 120.0° | 119.9° |
| C25 | C27 | C29 | H271 | 118.9° | 120.0° |
| C25 | C27 | C29 | O30 | 135.1° | 175.0° |
| C27 | C25 | C23 | H231 | 54.8° | 60.0° |
| C27 | C25 | O26 | H261 | 60.0° | 60.0° |
| C25 | C27 | O28 | H281 | 180.0° | 60.0° |
| C25 | C27 | C29 | H291 | 15.3° | 55.0° |
| C25 | C27 | C29 | H292 | 105.0° | 65.0° |
| O28 | C27 | C29 | H271 | 121.1° | 120.1° |
| O28 | C27 | C29 | O30 | 104.8° | 65.0° |
| O28 | C27 | C25 | H251 | 18.8° | 60.0° |
| O28 | C27 | C29 | H291 | 135.3° | 175.0° |
| O28 | C27 | C29 | H292 | 15.0° | 55.0° |
| C27 | C29 | O30 | H291 | 119.8° | 120.0° |
| C27 | C29 | O30 | H292 | 119.8° | 120.0° |
| C27 | C29 | O30 | P31 | 171.2° | 180.0° |
| C29 | C27 | C25 | H251 | 138.9° | 60.0° |
| C29 | C27 | O28 | H281 | 59.9° | 59.9° |
| C27 | C29 | H291 | H292 | 120.5° | 120.0° |
| C29 | O30 | P31 | O32 | 160.4° | 175.0° |
| C29 | O30 | P31 | O40 | 79.6° | 55.0° |
| C29 | O30 | P31 | O41 | 40.4° | 65.0° |
| O30 | C29 | C27 | H271 | 16.2° | 55.0° |
| O30 | C29 | H291 | H292 | 120.6° | 120.0° |
| O30 | P31 | O32 | C33 | 148.1° | 175.0° |
| O30 | P31 | O32 | O40 | 120.0° | 119.9° |
| O30 | P31 | O32 | O41 | 120.0° | 120.0° |
| O30 | P31 | O40 | O41 | 120.0° | 120.0° |
| P31 | O30 | C29 | H291 | 69.0° | 60.0° |
| P31 | O30 | C29 | H292 | 51.4° | 60.1° |
| O30 | P31 | O41 | H2 | 120.0° | 60.0° |
| O32 | C33 | C34 | H331 | 119.8° | 120.0° |
| O32 | C33 | C34 | H332 | 119.8° | 120.0° |
| O32 | C33 | C34 | C35 | 100.4° | 180.0° |
| C33 | O32 | P31 | O40 | 91.9° | 55.0° |
| C33 | O32 | P31 | O41 | 28.1° | 65.0° |
| O32 | C33 | H331 | H332 | 120.5° | 120.0° |
| O32 | C33 | C34 | H341 | 139.2° | 60.0° |
| O32 | C33 | C34 | H342 | 20.0° | 60.0° |
| C33 | C34 | C35 | H341 | 120.4° | 120.0° |
| C33 | C34 | C35 | H342 | 120.4° | 120.0° |
| C33 | C34 | C35 | C36 | 174.4° | 180.0° |
| C34 | C33 | O32 | P31 | 165.2° | 180.0° |
| C34 | C33 | H331 | H332 | 120.5° | 120.0° |
| C33 | C34 | H341 | H342 | 118.7° | 120.0° |
| C33 | C34 | C35 | H351 | 65.2° | 60.0° |
| C33 | C34 | C35 | H352 | 54.0° | 60.0° |
| C34 | C35 | C36 | H351 | 120.4° | 120.0° |
| C34 | C35 | C36 | H352 | 120.4° | 120.0° |
| C34 | C35 | C36 | C37 | 151.1° | NaN° |
| C35 | C34 | C33 | H331 | 19.4° | 60.0° |
| C35 | C34 | C33 | H332 | 139.7° | 60.0° |
| C35 | C34 | H341 | H342 | 118.7° | 120.0° |
| C34 | C35 | H351 | H352 | 118.7° | 120.0° |
| C34 | C35 | C36 | H361 | 88.5° | 60.0° |
| C34 | C35 | C36 | H362 | 30.7° | 60.0° |
| C35 | C36 | C37 | H361 | 120.4° | 120.0° |
| C35 | C36 | C37 | H362 | 120.4° | 120.0° |
| C35 | C36 | C37 | C38 | 168.1° | 180.0° |
| C36 | C35 | C34 | H341 | 54.0° | 60.0° |
| C36 | C35 | C34 | H342 | 65.2° | 60.0° |
| C36 | C35 | H351 | H352 | 118.7° | 120.0° |
| C35 | C36 | H361 | H362 | 118.7° | 120.0° |
| C35 | C36 | C37 | H371 | 71.5° | 60.0° |
| C35 | C36 | C37 | H372 | 47.6° | 60.1° |
| C36 | C37 | C38 | H371 | 120.4° | 120.0° |
| C36 | C37 | C38 | H372 | 120.4° | 120.0° |
| C36 | C37 | C38 | N39 | 168.3° | 180.0° |
| C37 | C36 | C35 | H351 | 30.7° | 60.0° |
| C37 | C36 | C35 | H352 | 88.5° | 60.0° |
| C37 | C36 | H361 | H362 | 118.7° | 120.0° |
| C36 | C37 | H371 | H372 | 118.7° | 120.0° |
| C36 | C37 | C38 | H381 | 71.6° | 60.0° |
| C36 | C37 | C38 | H382 | 48.2° | 60.0° |
| C37 | C38 | N39 | H381 | 120.2° | 120.0° |
| C37 | C38 | N39 | H382 | 120.2° | 120.0° |
| C38 | C37 | C36 | H361 | 47.6° | 60.0° |
| C38 | C37 | C36 | H362 | 71.5° | 60.1° |
| C38 | C37 | H371 | H372 | 118.7° | 120.0° |
| C37 | C38 | H381 | H382 | 119.6° | 120.0° |
| C37 | C38 | N39 | H391 | 180.0° | 56.1° |
| C37 | C38 | N39 | H392 | 60.0° | 179.9° |
| N39 | C38 | C37 | H371 | 47.9° | 60.0° |
| N39 | C38 | C37 | H372 | 71.3° | 60.1° |
| N39 | C38 | H381 | H382 | 119.5° | 120.0° |
| C38 | N39 | H391 | H392 | 120.0° | 123.9° |
| O32 | P31 | O40 | O41 | 120.0° | 120.1° |
| P31 | O32 | C33 | H331 | 75.0° | 60.0° |
| P31 | O32 | C33 | H332 | 45.4° | 60.0° |
| O32 | P31 | O41 | H2 | 120.0° | 60.0° |
| O40 | P31 | O41 | H2 | 0.0° | 180.0° |
| O21 | P20 | O42 | O43 | 120.0° | 120.0° |
| P20 | O21 | C22 | H221 | 69.4° | 60.0° |
| P20 | O21 | C22 | H222 | 50.9° | 60.0° |
| O21 | P20 | O42 | H3 | 120.0° | 60.0° |
| O43 | P20 | O42 | H3 | 0.0° | 180.0° |
| O10 | P09 | O44 | O45 | 120.0° | 120.0° |
| P09 | O10 | C11 | H111 | 49.9° | 60.0° |
| P09 | O10 | C11 | H112 | 70.5° | 60.0° |
| O10 | P09 | O45 | H4 | 120.0° | 60.0° |
| O44 | P09 | O45 | H4 | 0.0° | 180.0° |
| C03 | C02 | C46 | H021 | 118.8° | 120.0° |
| C03 | C02 | C46 | O47 | 84.8° | 175.0° |
| C02 | C03 | C05 | H051 | 131.5° | 60.0° |
| C03 | C02 | O01 | H011 | 180.0° | 60.0° |
| C02 | C03 | O04 | H041 | 60.0° | 60.0° |
| C03 | C02 | C46 | H461 | 35.0° | 65.0° |
| C03 | C02 | C46 | H462 | 155.3° | 55.1° |
| C02 | C46 | O47 | H461 | 119.8° | 120.0° |
| C02 | C46 | O47 | H462 | 119.8° | 119.9° |
| C02 | C46 | O47 | P48 | 145.1° | 180.0° |
| C46 | C02 | C03 | H031 | 79.2° | 60.0° |
| C46 | C02 | O01 | H011 | 59.9° | 60.0° |
| C02 | C46 | H461 | H462 | 120.5° | 120.0° |
| C46 | O47 | P48 | O49 | 122.0° | 174.9° |
| C46 | O47 | P48 | O59 | 2.0° | 55.0° |
| C46 | O47 | P48 | O60 | 118.0° | 65.0° |
| O47 | C46 | C02 | H021 | 156.4° | 55.0° |
| O47 | C46 | H461 | H462 | 120.5° | 120.0° |
| O47 | P48 | O49 | C50 | 120.0° | 175.0° |
| O47 | P48 | O49 | O59 | 120.0° | 119.9° |
| O47 | P48 | O49 | O60 | 120.0° | 120.0° |
| O47 | P48 | O59 | O60 | 120.0° | 120.0° |
| P48 | O47 | C46 | H461 | 95.1° | 60.0° |
| P48 | O47 | C46 | H462 | 25.2° | 60.1° |
| O47 | P48 | O60 | H5 | 120.0° | 60.0° |
| O49 | C50 | C51 | H501 | 119.8° | 120.0° |
| O49 | C50 | C51 | H502 | 119.9° | 120.0° |
| O49 | C50 | C51 | O52 | 142.9° | 65.0° |
| O49 | C50 | C51 | C53 | 97.1° | 175.0° |
| C50 | O49 | P48 | O59 | 119.9° | 55.1° |
| C50 | O49 | P48 | O60 | 0.0° | 65.0° |
| O49 | C50 | C51 | H511 | 21.7° | 55.0° |
| O49 | C50 | H501 | H502 | 120.5° | 120.0° |
| C50 | C51 | O52 | C53 | 120.1° | 120.0° |
| C50 | C51 | O52 | H511 | 119.9° | 119.9° |
| C50 | C51 | C53 | H511 | 118.7° | 119.9° |
| C50 | C51 | C53 | O54 | 100.8° | 60.0° |
| C50 | C51 | C53 | C55 | 139.1° | 180.0° |
| C51 | C50 | O49 | P48 | 133.4° | 180.0° |
| C50 | C51 | C53 | H531 | 20.2° | 60.0° |
| C51 | C50 | H501 | H502 | 120.5° | 119.9° |
| C50 | C51 | O52 | H521 | 180.0° | 60.0° |
| O52 | C51 | C53 | H511 | 121.3° | 120.1° |
| O52 | C51 | C53 | O54 | 139.1° | 180.0° |
| O52 | C51 | C53 | C55 | 19.1° | 60.0° |
| O52 | C51 | C53 | H531 | 99.8° | 60.0° |
| O52 | C51 | C50 | H501 | 23.1° | 55.1° |
| O52 | C51 | C50 | H502 | 97.3° | 175.0° |
| C51 | C53 | O54 | C55 | 120.1° | 120.0° |
| C51 | C53 | O54 | H531 | 120.0° | 120.0° |
| C51 | C53 | C55 | H531 | 118.9° | 120.0° |
| C51 | C53 | C55 | O56 | 79.7° | 60.0° |
| C51 | C53 | C55 | C57 | 160.2° | 180.0° |
| C51 | C53 | C55 | H551 | 41.3° | 60.0° |
| C53 | C51 | C50 | H501 | 143.1° | 65.0° |
| C53 | C51 | C50 | H502 | 22.8° | 55.0° |
| C53 | C51 | O52 | H521 | 59.9° | 60.0° |
| C51 | C53 | O54 | H541 | 180.0° | 60.1° |
| O54 | C53 | C55 | H531 | 121.1° | 120.0° |
| O54 | C53 | C55 | O56 | 160.2° | 180.0° |
| O54 | C53 | C55 | C57 | 40.2° | 60.0° |
| O54 | C53 | C51 | H511 | 17.8° | 60.0° |
| O54 | C53 | C55 | H551 | 78.7° | 60.1° |
| C53 | C55 | O56 | C57 | 120.0° | 120.0° |
| C53 | C55 | O56 | H551 | 120.0° | 120.0° |
| C53 | C55 | C57 | H551 | 118.9° | 120.0° |
| C53 | C55 | C57 | O58 | 168.7° | 175.0° |
| C55 | C53 | C51 | H511 | 102.2° | 60.1° |
| C55 | C53 | O54 | H541 | 59.9° | 60.0° |
| C53 | C55 | O56 | H561 | 180.0° | 60.0° |
| C53 | C55 | C57 | H571 | 48.8° | 65.0° |
| C53 | C55 | C57 | H572 | 71.5° | 55.0° |
| O56 | C55 | C57 | H551 | 121.1° | 120.0° |
| O56 | C55 | C57 | O58 | 48.6° | 65.0° |
| O56 | C55 | C53 | H531 | 39.2° | 60.0° |
| O56 | C55 | C57 | H571 | 71.2° | 55.0° |
| O56 | C55 | C57 | H572 | 168.5° | 175.0° |
| C55 | C57 | O58 | H571 | 119.8° | 120.0° |
| C55 | C57 | O58 | H572 | 119.8° | 120.0° |
| C57 | C55 | C53 | H531 | 80.9° | 60.0° |
| C57 | C55 | O56 | H561 | 60.0° | 60.0° |
| C55 | C57 | H571 | H572 | 120.5° | 120.0° |
| C55 | C57 | O58 | H581 | 180.0° | 179.9° |
| O58 | C57 | C55 | H551 | 72.5° | 55.0° |
| O58 | C57 | H571 | H572 | 120.5° | 120.0° |
| O49 | P48 | O59 | O60 | 119.9° | 120.1° |
| P48 | O49 | C50 | H501 | 13.5° | 60.0° |
| P48 | O49 | C50 | H502 | 106.8° | 60.0° |
| O49 | P48 | O60 | H5 | 120.0° | 60.0° |
| O59 | P48 | O60 | H5 | 0.0° | 180.0° |
| H021 | C02 | C03 | H031 | 162.1° | 180.0° |
| H021 | C02 | O01 | H011 | 59.9° | 180.0° |
| H021 | C02 | C46 | H461 | 83.8° | 175.0° |
| H021 | C02 | C46 | H462 | 36.6° | 64.9° |
| H031 | C03 | C05 | H051 | 109.7° | 180.0° |
| H031 | C03 | O04 | H041 | 60.0° | 179.9° |
| H051 | C05 | O06 | H061 | 60.0° | 180.0° |
| H051 | C05 | C07 | H071 | 154.7° | 65.0° |
| H051 | C05 | C07 | H072 | 84.9° | 175.0° |
| H121 | C12 | C14 | H141 | 135.7° | 180.0° |
| H121 | C12 | C11 | H111 | 56.4° | 65.0° |
| H121 | C12 | C11 | H112 | 176.8° | 175.0° |
| H121 | C12 | O13 | H131 | 60.0° | 180.0° |
| H141 | C14 | C16 | H161 | 70.6° | 180.0° |
| H141 | C14 | O15 | H151 | 60.0° | 180.0° |
| H161 | C16 | O17 | H171 | 60.1° | 180.0° |
| H161 | C16 | C18 | H181 | 67.7° | 65.0° |
| H161 | C16 | C18 | H182 | 171.9° | 175.0° |
| H231 | C23 | C25 | H251 | 173.7° | 180.0° |
| H231 | C23 | C22 | H221 | 90.4° | 65.1° |
| H231 | C23 | C22 | H222 | 149.3° | 175.0° |
| H231 | C23 | O24 | H241 | 60.1° | 180.0° |
| H251 | C25 | C27 | H271 | 102.3° | 180.0° |
| H251 | C25 | O26 | H261 | 60.0° | 180.0° |
| H271 | C27 | O28 | H281 | 60.0° | 180.0° |
| H271 | C27 | C29 | H291 | 103.6° | 64.9° |
| H271 | C27 | C29 | H292 | 136.1° | 175.0° |
| H511 | C51 | C53 | H531 | 138.9° | 180.0° |
| H511 | C51 | C50 | H501 | 98.1° | 175.0° |
| H511 | C51 | C50 | H502 | 141.6° | 65.0° |
| H511 | C51 | O52 | H521 | 60.2° | 179.9° |
| H531 | C53 | C55 | H551 | 160.2° | 180.0° |
| H531 | C53 | O54 | H541 | 60.0° | 180.0° |
| H551 | C55 | O56 | H561 | 60.0° | 180.0° |
| H551 | C55 | C57 | H571 | 167.7° | 174.9° |
| H551 | C55 | C57 | H572 | 47.4° | 65.0° |
| H331 | C33 | C34 | H341 | 101.0° | 180.0° |
| H331 | C33 | C34 | H342 | 139.8° | 60.0° |
| H332 | C33 | C34 | H341 | 19.3° | 60.0° |
| H332 | C33 | C34 | H342 | 99.9° | 180.0° |
| H341 | C34 | C35 | H351 | 174.4° | NaN° |
| H341 | C34 | C35 | H352 | 66.4° | 60.0° |
| H342 | C34 | C35 | H351 | 55.2° | 60.0° |
| H342 | C34 | C35 | H352 | 174.4° | 180.0° |
| H351 | C35 | C36 | H361 | 151.1° | 180.0° |
| H351 | C35 | C36 | H362 | 89.7° | 60.0° |
| H352 | C35 | C36 | H361 | 31.9° | 60.0° |
| H352 | C35 | C36 | H362 | 151.1° | 180.0° |
| H361 | C36 | C37 | H371 | 168.0° | 180.0° |
| H361 | C36 | C37 | H372 | 72.8° | 59.9° |
| H362 | C36 | C37 | H371 | 48.9° | 60.0° |
| H362 | C36 | C37 | H372 | 168.1° | 180.0° |
| H371 | C37 | C38 | H381 | 168.0° | 180.0° |
| H371 | C37 | C38 | H382 | 72.3° | 60.0° |
| H372 | C37 | C38 | H381 | 48.8° | 60.0° |
| H372 | C37 | C38 | H382 | 168.6° | 180.0° |
| H381 | C38 | N39 | H391 | 59.8° | 63.9° |
| H381 | C38 | N39 | H392 | 179.8° | 60.0° |
| H382 | C38 | N39 | H391 | 59.8° | 176.1° |
| H382 | C38 | N39 | H392 | 60.1° | 59.9° |
| H571 | C57 | O58 | H581 | 60.2° | 60.1° |
| H572 | C57 | O58 | H581 | 60.2° | 59.9° |
