C30
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C01 | C02 | sing | 1.51Å | 1.49Å | |
C03 | C02 | sing | 1.51Å | 1.52Å | |
C02 | C04 | doub | 1.31Å | 1.39Å | |
C04 | C05 | sing | 1.51Å | 1.56Å | |
C05 | C06 | sing | 1.53Å | 1.62Å | |
C06 | C07 | sing | 1.51Å | 1.59Å | |
C16 | C15 | sing | 1.53Å | 1.60Å | |
C16 | C17 | sing | 1.51Å | 1.53Å | |
C15 | C14 | sing | 1.51Å | 1.54Å | |
C07 | C08 | sing | 1.51Å | 1.51Å | |
C07 | C09 | doub | 1.31Å | 1.42Å | |
C17 | C18 | sing | 1.51Å | 1.52Å | |
C17 | C19 | doub | 1.31Å | 1.42Å | |
C13 | C12 | sing | 1.51Å | 1.49Å | |
C14 | C12 | doub | 1.31Å | 1.40Å | |
C19 | C20 | sing | 1.51Å | 1.54Å | |
C09 | C10 | sing | 1.51Å | 1.53Å | |
C12 | C11 | sing | 1.51Å | 1.54Å | |
C28 | C27 | sing | 1.51Å | 1.51Å | |
C20 | C21 | sing | 1.53Å | 1.62Å | |
C10 | C11 | sing | 1.53Å | 1.59Å | |
O37 | P36 | doub | 1.48Å | 1.51Å | |
C27 | C26 | sing | 1.51Å | 1.54Å | |
C27 | C29 | doub | 1.31Å | 1.40Å | |
C26 | C25 | sing | 1.53Å | 1.58Å | |
O38 | P36 | sing | 1.61Å | 1.54Å | |
C21 | C22 | sing | 1.51Å | 1.55Å | |
C29 | C30 | sing | 1.51Å | 1.56Å | |
C25 | C24 | sing | 1.51Å | 1.52Å | |
P36 | O35 | sing | 1.61Å | 1.58Å | |
P36 | O39 | sing | 1.61Å | 1.78Å | |
C22 | C24 | doub | 1.31Å | 1.42Å | |
C22 | C23 | sing | 1.51Å | 1.50Å | |
C30 | O31 | sing | 1.43Å | 1.42Å | |
O35 | P32 | sing | 1.61Å | 1.62Å | |
O39 | C40 | sing | 1.43Å | 1.36Å | |
C40 | C49 | sing | 1.53Å | 1.66Å | |
C40 | O41 | sing | 1.43Å | 1.45Å | |
O48 | C47 | sing | 1.43Å | 1.43Å | |
C49 | C47 | sing | 1.53Å | 1.56Å | |
C49 | N50 | sing | 1.47Å | 1.53Å | |
C45 | C47 | sing | 1.53Å | 1.57Å | |
C45 | O46 | sing | 1.43Å | 1.43Å | |
C45 | C42 | sing | 1.53Å | 1.63Å | |
C43 | O44 | sing | 1.43Å | 1.43Å | |
C43 | C42 | sing | 1.53Å | 1.60Å | |
O31 | P32 | sing | 1.61Å | 1.73Å | |
N50 | C51 | sing | 1.35Å | 1.42Å | |
P32 | O34 | doub | 1.48Å | 1.54Å | |
P32 | O33 | sing | 1.61Å | 1.50Å | |
O41 | C42 | sing | 1.43Å | 1.43Å | |
O53 | C51 | doub | 1.21Å | 1.26Å | |
C51 | C52 | sing | 1.51Å | 1.56Å | |
C01 | H013 | sing | 1.09Å | 1.10Å | |
C01 | H012 | sing | 1.09Å | 1.10Å | |
C01 | H011 | sing | 1.09Å | 1.10Å | |
C03 | H033 | sing | 1.09Å | 1.10Å | |
C03 | H032 | sing | 1.09Å | 1.10Å | |
C03 | H031 | sing | 1.09Å | 1.10Å | |
C04 | H041 | sing | 1.08Å | 1.08Å | |
C05 | H051 | sing | 1.09Å | 1.10Å | |
C05 | H052 | sing | 1.09Å | 1.10Å | |
C06 | H061 | sing | 1.09Å | 1.10Å | |
C06 | H062 | sing | 1.09Å | 1.10Å | |
C08 | H081 | sing | 1.09Å | 1.10Å | |
C08 | H083 | sing | 1.09Å | 1.10Å | |
C08 | H082 | sing | 1.09Å | 1.10Å | |
C09 | H091 | sing | 1.08Å | 1.08Å | |
C10 | H101 | sing | 1.09Å | 1.10Å | |
C10 | H102 | sing | 1.09Å | 1.10Å | |
C11 | H111 | sing | 1.09Å | 1.10Å | |
C11 | H112 | sing | 1.09Å | 1.10Å | |
C13 | H133 | sing | 1.09Å | 1.10Å | |
C13 | H132 | sing | 1.09Å | 1.10Å | |
C13 | H131 | sing | 1.09Å | 1.10Å | |
C14 | H141 | sing | 1.08Å | 1.08Å | |
C15 | H152 | sing | 1.09Å | 1.10Å | |
C15 | H151 | sing | 1.09Å | 1.10Å | |
C16 | H162 | sing | 1.09Å | 1.10Å | |
C16 | H161 | sing | 1.09Å | 1.10Å | |
C18 | H183 | sing | 1.09Å | 1.10Å | |
C18 | H181 | sing | 1.09Å | 1.10Å | |
C18 | H182 | sing | 1.09Å | 1.10Å | |
C19 | H191 | sing | 1.08Å | 1.08Å | |
C20 | H202 | sing | 1.09Å | 1.10Å | |
C20 | H201 | sing | 1.09Å | 1.10Å | |
C21 | H211 | sing | 1.09Å | 1.10Å | |
C21 | H212 | sing | 1.09Å | 1.10Å | |
C23 | H231 | sing | 1.09Å | 1.10Å | |
C23 | H233 | sing | 1.09Å | 1.10Å | |
C23 | H232 | sing | 1.09Å | 1.10Å | |
C24 | H241 | sing | 1.08Å | 1.08Å | |
C25 | H252 | sing | 1.09Å | 1.10Å | |
C25 | H251 | sing | 1.09Å | 1.10Å | |
C26 | H261 | sing | 1.09Å | 1.10Å | |
C26 | H262 | sing | 1.09Å | 1.10Å | |
C28 | H282 | sing | 1.09Å | 1.10Å | |
C28 | H281 | sing | 1.09Å | 1.10Å | |
C28 | H283 | sing | 1.09Å | 1.10Å | |
C29 | H291 | sing | 1.08Å | 1.08Å | |
C30 | H301 | sing | 1.09Å | 1.10Å | |
C30 | H302 | sing | 1.09Å | 1.10Å | |
C40 | H401 | sing | 1.09Å | 1.10Å | |
C42 | H421 | sing | 1.09Å | 1.10Å | |
C43 | H431 | sing | 1.09Å | 1.10Å | |
C43 | H432 | sing | 1.09Å | 1.10Å | |
C45 | H451 | sing | 1.09Å | 1.10Å | |
C47 | H471 | sing | 1.09Å | 1.10Å | |
C49 | H491 | sing | 1.09Å | 1.10Å | |
C52 | H522 | sing | 1.09Å | 1.10Å | |
C52 | H523 | sing | 1.09Å | 1.10Å | |
C52 | H521 | sing | 1.09Å | 1.10Å | |
N50 | H501 | sing | 0.97Å | 1.00Å | |
O33 | H1 | sing | 0.97Å | 0.95Å | |
O38 | H2 | sing | 0.97Å | 0.95Å | |
O44 | H441 | sing | 0.97Å | 0.95Å | |
O46 | H461 | sing | 0.97Å | 0.95Å | |
O48 | H481 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C01 | C02 | C03 | 118.4° | 120.0° |
C01 | C02 | C04 | 119.4° | 120.0° |
C02 | C01 | H013 | 109.5° | 109.5° |
C02 | C01 | H012 | 109.5° | 109.5° |
C02 | C01 | H011 | 109.5° | 109.5° |
C03 | C02 | C04 | 122.2° | 120.0° |
C02 | C03 | H033 | 109.5° | 109.4° |
C02 | C03 | H032 | 109.5° | 109.5° |
C02 | C03 | H031 | 109.5° | 109.5° |
C02 | C04 | C05 | 124.4° | 120.0° |
C02 | C04 | H041 | 117.8° | 120.0° |
C04 | C05 | C06 | 119.8° | 109.5° |
C05 | C04 | H041 | 117.8° | 120.0° |
C04 | C05 | H051 | 106.8° | 109.5° |
C04 | C05 | H052 | 106.8° | 109.5° |
C05 | C06 | C07 | 118.3° | 109.5° |
C06 | C05 | H051 | 106.8° | 109.4° |
C06 | C05 | H052 | 106.8° | 109.5° |
C05 | C06 | H061 | 107.2° | 109.4° |
C05 | C06 | H062 | 107.2° | 109.5° |
C06 | C07 | C08 | 122.3° | 120.0° |
C06 | C07 | C09 | 119.5° | 120.0° |
C07 | C06 | H061 | 107.2° | 109.5° |
C07 | C06 | H062 | 107.2° | 109.5° |
C15 | C16 | C17 | 115.7° | 109.5° |
C16 | C15 | C14 | 115.6° | 109.5° |
C16 | C15 | H152 | 107.9° | 109.5° |
C16 | C15 | H151 | 107.9° | 109.4° |
C15 | C16 | H162 | 107.9° | 109.5° |
C15 | C16 | H161 | 107.9° | 109.4° |
C16 | C17 | C18 | 120.8° | 120.0° |
C16 | C17 | C19 | 118.8° | 120.0° |
C17 | C16 | H162 | 107.9° | 109.5° |
C17 | C16 | H161 | 107.9° | 109.5° |
C15 | C14 | C12 | 123.5° | 120.0° |
C15 | C14 | H141 | 118.2° | 120.0° |
C14 | C15 | H152 | 107.9° | 109.5° |
C14 | C15 | H151 | 107.9° | 109.5° |
C08 | C07 | C09 | 118.2° | 120.0° |
C07 | C08 | H081 | 109.5° | 109.5° |
C07 | C08 | H083 | 109.5° | 109.5° |
C07 | C08 | H082 | 109.4° | 109.5° |
C07 | C09 | C10 | 125.5° | 120.0° |
C07 | C09 | H091 | 117.2° | 120.0° |
C18 | C17 | C19 | 120.4° | 120.0° |
C17 | C18 | H183 | 109.5° | 109.4° |
C17 | C18 | H181 | 109.4° | 109.5° |
C17 | C18 | H182 | 109.5° | 109.4° |
C17 | C19 | C20 | 124.3° | 120.0° |
C17 | C19 | H191 | 117.8° | 120.0° |
C13 | C12 | C14 | 118.6° | 120.0° |
C13 | C12 | C11 | 120.1° | 120.0° |
C12 | C13 | H133 | 109.5° | 109.5° |
C12 | C13 | H132 | 109.5° | 109.5° |
C12 | C13 | H131 | 109.4° | 109.5° |
C14 | C12 | C11 | 121.2° | 120.0° |
C12 | C14 | H141 | 118.2° | 120.0° |
C19 | C20 | C21 | 117.7° | 109.5° |
C20 | C19 | H191 | 117.8° | 120.0° |
C19 | C20 | H202 | 107.4° | 109.5° |
C19 | C20 | H201 | 107.4° | 109.5° |
C09 | C10 | C11 | 111.8° | 109.4° |
C10 | C09 | H091 | 117.3° | 120.0° |
C09 | C10 | H101 | 108.9° | 109.4° |
C09 | C10 | H102 | 108.9° | 109.5° |
C12 | C11 | C10 | 113.5° | 109.4° |
C12 | C11 | H111 | 108.4° | 109.5° |
C12 | C11 | H112 | 108.5° | 109.5° |
C28 | C27 | C26 | 119.3° | 120.0° |
C28 | C27 | C29 | 118.1° | 120.0° |
C27 | C28 | H282 | 109.5° | 109.5° |
C27 | C28 | H281 | 109.5° | 109.5° |
C27 | C28 | H283 | 109.4° | 109.5° |
C20 | C21 | C22 | 117.6° | 109.5° |
C21 | C20 | H202 | 107.4° | 109.5° |
C21 | C20 | H201 | 107.4° | 109.5° |
C20 | C21 | H211 | 107.4° | 109.5° |
C20 | C21 | H212 | 107.4° | 109.5° |
C11 | C10 | H101 | 108.9° | 109.5° |
C11 | C10 | H102 | 108.9° | 109.5° |
C10 | C11 | H111 | 108.5° | 109.5° |
C10 | C11 | H112 | 108.4° | 109.5° |
O37 | P36 | O38 | 112.5° | 109.5° |
O37 | P36 | O35 | 116.9° | 109.5° |
O37 | P36 | O39 | 103.5° | 109.5° |
C26 | C27 | C29 | 122.5° | 120.0° |
C27 | C26 | C25 | 115.8° | 109.4° |
C27 | C26 | H261 | 107.9° | 109.5° |
C27 | C26 | H262 | 107.9° | 109.5° |
C27 | C29 | C30 | 121.8° | 120.0° |
C27 | C29 | H291 | 119.1° | 120.0° |
C26 | C25 | C24 | 114.3° | 109.4° |
C26 | C25 | H252 | 108.2° | 109.5° |
C26 | C25 | H251 | 108.2° | 109.5° |
C25 | C26 | H261 | 107.9° | 109.5° |
C25 | C26 | H262 | 107.9° | 109.5° |
O38 | P36 | O35 | 111.3° | 109.4° |
O38 | P36 | O39 | 99.4° | 109.5° |
P36 | O38 | H2 | 109.5° | 114.0° |
C21 | C22 | C24 | 121.8° | 120.0° |
C21 | C22 | C23 | 119.6° | 120.0° |
C22 | C21 | H211 | 107.4° | 109.4° |
C22 | C21 | H212 | 107.4° | 109.5° |
C29 | C30 | O31 | 111.9° | 109.5° |
C30 | C29 | H291 | 119.1° | 120.0° |
C29 | C30 | H301 | 108.9° | 109.5° |
C29 | C30 | H302 | 108.9° | 109.4° |
C25 | C24 | C22 | 126.5° | 120.0° |
C25 | C24 | H241 | 116.8° | 120.0° |
C24 | C25 | H252 | 108.3° | 109.4° |
C24 | C25 | H251 | 108.2° | 109.5° |
O35 | P36 | O39 | 111.5° | 109.5° |
P36 | O35 | P32 | 127.9° | 134.0° |
P36 | O39 | C40 | 124.3° | 123.0° |
C24 | C22 | C23 | 118.5° | 120.0° |
C22 | C24 | H241 | 116.7° | 120.0° |
C22 | C23 | H231 | 109.5° | 109.5° |
C22 | C23 | H233 | 109.5° | 109.5° |
C22 | C23 | H232 | 109.5° | 109.5° |
C30 | O31 | P32 | 120.9° | 122.9° |
O31 | C30 | H301 | 108.9° | 109.5° |
O31 | C30 | H302 | 108.9° | 109.5° |
O35 | P32 | O31 | 111.2° | 109.4° |
O35 | P32 | O34 | 111.4° | 109.5° |
O35 | P32 | O33 | 114.6° | 109.5° |
O39 | C40 | C49 | 112.5° | 109.5° |
O39 | C40 | O41 | 110.7° | 109.5° |
O39 | C40 | H401 | 109.6° | 109.5° |
C49 | C40 | O41 | 109.5° | 109.4° |
C40 | C49 | C47 | 106.4° | 109.2° |
C40 | C49 | N50 | 111.9° | 109.5° |
C49 | C40 | H401 | 105.9° | 109.5° |
C40 | C49 | H491 | 107.9° | 109.5° |
C40 | O41 | C42 | 119.5° | 114.1° |
O41 | C40 | H401 | 108.4° | 109.4° |
O48 | C47 | C49 | 105.6° | 109.6° |
O48 | C47 | C45 | 107.4° | 109.5° |
O48 | C47 | H471 | 112.5° | 109.5° |
C47 | O48 | H481 | 109.5° | 114.1° |
C47 | C49 | N50 | 111.9° | 109.5° |
C49 | C47 | C45 | 110.5° | 109.1° |
C49 | C47 | H471 | 110.5° | 109.6° |
C47 | C49 | H491 | 109.1° | 109.6° |
C49 | N50 | C51 | 123.3° | 120.0° |
N50 | C49 | H491 | 109.5° | 109.6° |
C49 | N50 | H501 | 118.4° | 119.9° |
C47 | C45 | O46 | 107.6° | 109.6° |
C47 | C45 | C42 | 108.4° | 109.1° |
C47 | C45 | H451 | 110.7° | 109.5° |
C45 | C47 | H471 | 110.3° | 109.6° |
O46 | C45 | C42 | 107.4° | 109.5° |
O46 | C45 | H451 | 112.8° | 109.6° |
C45 | O46 | H461 | 109.5° | 114.0° |
C45 | C42 | C43 | 107.2° | 109.5° |
C45 | C42 | O41 | 106.1° | 109.4° |
C45 | C42 | H421 | 109.4° | 109.5° |
C42 | C45 | H451 | 109.9° | 109.5° |
O44 | C43 | C42 | 108.8° | 109.5° |
O44 | C43 | H431 | 109.6° | 109.5° |
O44 | C43 | H432 | 109.6° | 109.5° |
C43 | O44 | H441 | 109.5° | 114.0° |
C43 | C42 | O41 | 112.0° | 109.5° |
C43 | C42 | H421 | 109.7° | 109.5° |
C42 | C43 | H431 | 109.6° | 109.4° |
C42 | C43 | H432 | 109.6° | 109.5° |
O31 | P32 | O34 | 104.9° | 109.5° |
O31 | P32 | O33 | 104.1° | 109.5° |
N50 | C51 | O53 | 120.0° | 120.0° |
N50 | C51 | C52 | 126.2° | 120.0° |
C51 | N50 | H501 | 118.4° | 120.1° |
O34 | P32 | O33 | 110.0° | 109.5° |
P32 | O33 | H1 | 109.5° | 114.0° |
O41 | C42 | H421 | 112.2° | 109.5° |
O53 | C51 | C52 | 113.8° | 120.0° |
C51 | C52 | H522 | 109.5° | 109.5° |
C51 | C52 | H523 | 109.5° | 109.5° |
C51 | C52 | H521 | 109.5° | 109.5° |
H013 | C01 | H012 | 109.5° | 109.5° |
H013 | C01 | H011 | 109.5° | 109.5° |
H012 | C01 | H011 | 109.5° | 109.4° |
H033 | C03 | H032 | 109.4° | 109.5° |
H033 | C03 | H031 | 109.4° | 109.4° |
H032 | C03 | H031 | 109.5° | 109.5° |
H051 | C05 | H052 | 109.5° | 109.4° |
H061 | C06 | H062 | 109.4° | 109.4° |
H081 | C08 | H083 | 109.4° | 109.5° |
H081 | C08 | H082 | 109.5° | 109.5° |
H083 | C08 | H082 | 109.5° | 109.5° |
H101 | C10 | H102 | 109.4° | 109.5° |
H111 | C11 | H112 | 109.5° | 109.5° |
H133 | C13 | H132 | 109.4° | 109.5° |
H133 | C13 | H131 | 109.5° | 109.5° |
H132 | C13 | H131 | 109.5° | 109.4° |
H152 | C15 | H151 | 109.5° | 109.5° |
H162 | C16 | H161 | 109.5° | 109.5° |
H183 | C18 | H181 | 109.5° | 109.6° |
H183 | C18 | H182 | 109.5° | 109.5° |
H181 | C18 | H182 | 109.5° | 109.5° |
H202 | C20 | H201 | 109.5° | 109.5° |
H211 | C21 | H212 | 109.5° | 109.5° |
H231 | C23 | H233 | 109.4° | 109.5° |
H231 | C23 | H232 | 109.4° | 109.5° |
H233 | C23 | H232 | 109.5° | 109.5° |
H252 | C25 | H251 | 109.5° | 109.5° |
H261 | C26 | H262 | 109.4° | 109.5° |
H282 | C28 | H281 | 109.5° | 109.4° |
H282 | C28 | H283 | 109.5° | 109.5° |
H281 | C28 | H283 | 109.5° | 109.5° |
H301 | C30 | H302 | 109.5° | 109.5° |
H431 | C43 | H432 | 109.5° | 109.5° |
H522 | C52 | H523 | 109.5° | 109.5° |
H522 | C52 | H521 | 109.5° | 109.5° |
H523 | C52 | H521 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C01 | C02 | C03 | C04 | 179.1° | 180.0° |
C01 | C02 | C04 | C05 | 180.0° | 5.6° |
C02 | C01 | H013 | H012 | 120.0° | 120.1° |
C02 | C01 | H013 | H011 | 120.0° | 120.0° |
C02 | C01 | H012 | H011 | 120.0° | 120.0° |
C01 | C02 | C03 | H033 | 180.0° | 90.0° |
C01 | C02 | C03 | H032 | 60.0° | 150.0° |
C01 | C02 | C03 | H031 | 60.0° | 29.9° |
C01 | C02 | C04 | H041 | 0.0° | 174.4° |
C03 | C02 | C04 | C05 | 0.9° | 174.4° |
C03 | C02 | C01 | H013 | 180.0° | 125.1° |
C03 | C02 | C01 | H012 | 60.0° | 5.0° |
C03 | C02 | C01 | H011 | 60.0° | 114.9° |
C02 | C03 | H033 | H032 | 120.0° | 120.0° |
C02 | C03 | H033 | H031 | 120.0° | 119.9° |
C02 | C03 | H032 | H031 | 120.0° | 120.0° |
C03 | C02 | C04 | H041 | 179.1° | 5.6° |
C02 | C04 | C05 | H041 | 180.0° | 180.0° |
C02 | C04 | C05 | C06 | 86.6° | 120.0° |
C04 | C02 | C01 | H013 | 0.9° | 55.0° |
C04 | C02 | C01 | H012 | 119.2° | 175.0° |
C04 | C02 | C01 | H011 | 120.9° | 65.1° |
C04 | C02 | C03 | H033 | 0.9° | 90.1° |
C04 | C02 | C03 | H032 | 120.9° | 30.0° |
C04 | C02 | C03 | H031 | 119.1° | 150.0° |
C02 | C04 | C05 | H051 | 152.0° | 120.0° |
C02 | C04 | C05 | H052 | 34.9° | 0.0° |
C04 | C05 | C06 | H051 | 121.5° | 120.0° |
C04 | C05 | C06 | H052 | 121.5° | 120.0° |
C04 | C05 | C06 | C07 | 121.9° | 180.0° |
C04 | C05 | H051 | H052 | 115.3° | 120.0° |
C04 | C05 | C06 | H061 | 116.8° | 60.0° |
C04 | C05 | C06 | H062 | 0.6° | 60.0° |
C05 | C06 | C07 | H061 | 121.3° | 120.0° |
C05 | C06 | C07 | H062 | 121.3° | 120.0° |
C05 | C06 | C07 | C08 | 18.2° | 85.0° |
C05 | C06 | C07 | C09 | 161.6° | 95.0° |
C06 | C05 | C04 | H041 | 93.5° | 60.0° |
C06 | C05 | H051 | H052 | 115.3° | 119.9° |
C05 | C06 | H061 | H062 | 116.0° | 119.9° |
C06 | C07 | C08 | C09 | 179.9° | 180.0° |
C06 | C07 | C09 | C10 | 179.8° | 174.4° |
C07 | C06 | C05 | H051 | 0.4° | 60.0° |
C07 | C06 | C05 | H052 | 116.7° | 60.0° |
C07 | C06 | H061 | H062 | 116.0° | 120.0° |
C06 | C07 | C08 | H081 | 180.0° | 5.0° |
C06 | C07 | C08 | H083 | 60.0° | 114.9° |
C06 | C07 | C08 | H082 | 60.0° | 125.1° |
C06 | C07 | C09 | H091 | 0.1° | 5.6° |
C15 | C16 | C17 | H162 | 120.9° | 120.1° |
C15 | C16 | C17 | H161 | 120.9° | 120.0° |
C16 | C15 | C14 | H152 | 120.9° | 120.1° |
C16 | C15 | C14 | H151 | 120.9° | 120.0° |
C15 | C16 | C17 | C18 | 113.1° | 85.0° |
C15 | C16 | C17 | C19 | 66.1° | 95.0° |
C16 | C15 | C14 | C12 | 174.9° | 119.8° |
C16 | C15 | C14 | H141 | 5.1° | 60.3° |
C16 | C15 | H152 | H151 | 117.2° | 120.0° |
C15 | C16 | H162 | H161 | 117.2° | 120.0° |
C17 | C16 | C15 | C14 | 34.5° | NaN° |
C16 | C17 | C18 | C19 | 179.2° | 180.0° |
C16 | C17 | C19 | C20 | 179.5° | 175.0° |
C17 | C16 | C15 | H152 | 86.5° | 60.0° |
C17 | C16 | C15 | H151 | 155.3° | 60.0° |
C17 | C16 | H162 | H161 | 117.1° | 120.0° |
C16 | C17 | C18 | H183 | 180.0° | 3.1° |
C16 | C17 | C18 | H181 | 60.0° | 123.2° |
C16 | C17 | C18 | H182 | 60.0° | 116.8° |
C16 | C17 | C19 | H191 | 0.6° | 5.1° |
C15 | C14 | C12 | C13 | 0.0° | 5.1° |
C15 | C14 | C12 | H141 | 180.0° | 179.9° |
C15 | C14 | C12 | C11 | 179.8° | 174.9° |
C14 | C15 | H152 | H151 | 117.2° | 120.0° |
C14 | C15 | C16 | H162 | 86.4° | 60.0° |
C14 | C15 | C16 | H161 | 155.3° | 60.0° |
C08 | C07 | C09 | C10 | 0.3° | 5.6° |
C08 | C07 | C06 | H061 | 139.5° | 155.0° |
C08 | C07 | C06 | H062 | 103.1° | 35.0° |
C07 | C08 | H081 | H083 | 120.0° | 120.0° |
C07 | C08 | H081 | H082 | 120.0° | 120.0° |
C07 | C08 | H083 | H082 | 120.0° | 120.0° |
C08 | C07 | C09 | H091 | 179.7° | 174.4° |
C07 | C09 | C10 | H091 | 180.0° | 180.0° |
C07 | C09 | C10 | C11 | 125.4° | 120.0° |
C09 | C07 | C06 | H061 | 40.4° | 25.0° |
C09 | C07 | C06 | H062 | 77.1° | 145.0° |
C09 | C07 | C08 | H081 | 0.2° | 175.0° |
C09 | C07 | C08 | H083 | 120.1° | 65.1° |
C09 | C07 | C08 | H082 | 119.9° | 54.9° |
C07 | C09 | C10 | H101 | 5.1° | 120.0° |
C07 | C09 | C10 | H102 | 114.2° | 0.0° |
C18 | C17 | C19 | C20 | 1.4° | 5.0° |
C18 | C17 | C16 | H162 | 7.8° | 155.0° |
C18 | C17 | C16 | H161 | 126.0° | 35.0° |
C17 | C18 | H183 | H181 | 120.0° | 120.0° |
C17 | C18 | H183 | H182 | 120.0° | 119.9° |
C17 | C18 | H181 | H182 | 120.0° | 119.9° |
C18 | C17 | C19 | H191 | 178.6° | 174.9° |
C17 | C19 | C20 | H191 | 180.0° | 179.9° |
C17 | C19 | C20 | C21 | 115.7° | 122.6° |
C19 | C17 | C16 | H162 | 173.0° | 25.0° |
C19 | C17 | C16 | H161 | 54.8° | 145.0° |
C19 | C17 | C18 | H183 | 0.8° | 176.9° |
C19 | C17 | C18 | H181 | 119.2° | 56.8° |
C19 | C17 | C18 | H182 | 120.8° | 63.2° |
C17 | C19 | C20 | H202 | 5.5° | 117.4° |
C17 | C19 | C20 | H201 | 123.1° | 2.6° |
C13 | C12 | C14 | C11 | 179.9° | 180.0° |
C13 | C12 | C11 | C10 | 71.6° | 85.0° |
C13 | C12 | C11 | H111 | 167.8° | 155.0° |
C13 | C12 | C11 | H112 | 49.0° | 35.0° |
C12 | C13 | H133 | H132 | 120.0° | 120.0° |
C12 | C13 | H133 | H131 | 120.0° | 120.0° |
C12 | C13 | H132 | H131 | 120.0° | 119.9° |
C13 | C12 | C14 | H141 | 180.0° | 174.8° |
C14 | C12 | C11 | C10 | 108.3° | 95.0° |
C14 | C12 | C11 | H111 | 12.3° | 25.0° |
C14 | C12 | C11 | H112 | 131.2° | 145.0° |
C14 | C12 | C13 | H133 | 180.0° | 177.1° |
C14 | C12 | C13 | H132 | 60.0° | 57.0° |
C14 | C12 | C13 | H131 | 60.0° | 62.9° |
C12 | C14 | C15 | H152 | 54.0° | 120.2° |
C12 | C14 | C15 | H151 | 64.2° | 0.2° |
C19 | C20 | C21 | H202 | 121.2° | 120.0° |
C19 | C20 | C21 | H201 | 121.2° | 120.0° |
C19 | C20 | C21 | C22 | 80.3° | 180.0° |
C19 | C20 | H202 | H201 | 116.3° | 120.0° |
C19 | C20 | C21 | H211 | 40.9° | 60.0° |
C19 | C20 | C21 | H212 | 158.5° | 60.0° |
C09 | C10 | C11 | C12 | 19.4° | 180.0° |
C09 | C10 | C11 | H101 | 120.4° | 119.9° |
C09 | C10 | C11 | H102 | 120.4° | 120.0° |
C09 | C10 | H101 | H102 | 118.9° | 120.0° |
C09 | C10 | C11 | H111 | 101.1° | 60.0° |
C09 | C10 | C11 | H112 | 140.0° | 60.0° |
C12 | C11 | C10 | H111 | 120.6° | 120.0° |
C12 | C11 | C10 | H112 | 120.6° | 120.0° |
C12 | C11 | C10 | H101 | 100.9° | 60.1° |
C12 | C11 | C10 | H102 | 139.8° | 60.0° |
C12 | C11 | H111 | H112 | 118.2° | 120.0° |
C11 | C12 | C13 | H133 | 0.1° | 2.9° |
C11 | C12 | C13 | H132 | 120.1° | 123.0° |
C11 | C12 | C13 | H131 | 119.9° | 117.2° |
C11 | C12 | C14 | H141 | 0.1° | 5.2° |
C28 | C27 | C26 | C29 | 179.8° | 180.0° |
C28 | C27 | C26 | C25 | 63.1° | 85.6° |
C28 | C27 | C29 | C30 | 179.9° | 174.3° |
C28 | C27 | C26 | H261 | 175.9° | 34.3° |
C28 | C27 | C26 | H262 | 57.8° | 154.4° |
C27 | C28 | H282 | H281 | 120.0° | 120.0° |
C27 | C28 | H282 | H283 | 120.0° | 120.0° |
C27 | C28 | H281 | H283 | 120.0° | 120.0° |
C28 | C27 | C29 | H291 | 0.2° | 5.7° |
C20 | C21 | C22 | H211 | 121.1° | 120.0° |
C20 | C21 | C22 | H212 | 121.2° | 120.0° |
C20 | C21 | C22 | C24 | 62.5° | 94.1° |
C20 | C21 | C22 | C23 | 118.7° | 85.9° |
C21 | C20 | C19 | H191 | 64.3° | 57.4° |
C21 | C20 | H202 | H201 | 116.3° | 120.0° |
C20 | C21 | H211 | H212 | 116.3° | 120.1° |
C11 | C10 | C09 | H091 | 54.5° | 60.0° |
C11 | C10 | H101 | H102 | 118.9° | 120.1° |
C10 | C11 | H111 | H112 | 118.2° | 120.0° |
O37 | P36 | O38 | O35 | 133.5° | 120.0° |
O37 | P36 | O38 | O39 | 108.9° | 120.0° |
O37 | P36 | O35 | O39 | 118.7° | 120.0° |
O37 | P36 | O35 | P32 | 179.8° | 40.0° |
O37 | P36 | O39 | C40 | 29.4° | 55.0° |
O37 | P36 | O38 | H2 | 0.0° | 180.0° |
C27 | C26 | C25 | H261 | 120.9° | 119.9° |
C27 | C26 | C25 | H262 | 120.9° | 120.0° |
C26 | C27 | C29 | C30 | 0.3° | 5.7° |
C27 | C26 | C25 | C24 | 179.0° | 180.0° |
C27 | C26 | C25 | H252 | 58.3° | 60.1° |
C27 | C26 | C25 | H251 | 60.3° | 60.0° |
C27 | C26 | H261 | H262 | 117.1° | 120.1° |
C26 | C27 | C28 | H282 | 180.0° | 90.0° |
C26 | C27 | C28 | H281 | 60.0° | 150.1° |
C26 | C27 | C28 | H283 | 60.0° | 30.0° |
C26 | C27 | C29 | H291 | 179.7° | 174.3° |
C29 | C27 | C26 | C25 | 116.7° | 94.4° |
C27 | C29 | C30 | H291 | 180.0° | 180.0° |
C27 | C29 | C30 | O31 | 137.0° | 135.7° |
C29 | C27 | C26 | H261 | 4.3° | 145.7° |
C29 | C27 | C26 | H262 | 122.4° | 25.6° |
C29 | C27 | C28 | H282 | 0.2° | 90.0° |
C29 | C27 | C28 | H281 | 119.8° | 29.9° |
C29 | C27 | C28 | H283 | 120.2° | 150.0° |
C27 | C29 | C30 | H301 | 102.6° | 104.3° |
C27 | C29 | C30 | H302 | 16.7° | 15.7° |
C26 | C25 | C24 | H252 | 120.7° | 119.9° |
C26 | C25 | C24 | H251 | 120.7° | 120.0° |
C26 | C25 | C24 | C22 | 152.8° | 126.4° |
C26 | C25 | C24 | H241 | 27.2° | 53.5° |
C26 | C25 | H252 | H251 | 117.8° | 120.1° |
C25 | C26 | H261 | H262 | 117.1° | 120.0° |
O38 | P36 | O35 | O39 | 110.0° | 120.0° |
O38 | P36 | O35 | P32 | 48.6° | 80.0° |
O38 | P36 | O39 | C40 | 145.4° | 65.0° |
C21 | C22 | C24 | C25 | 0.7° | 6.5° |
C21 | C22 | C24 | C23 | 178.8° | 180.0° |
C22 | C21 | C20 | H202 | 158.5° | 60.0° |
C22 | C21 | C20 | H201 | 40.9° | 60.0° |
C22 | C21 | H211 | H212 | 116.3° | 119.9° |
C21 | C22 | C23 | H231 | 180.0° | 90.0° |
C21 | C22 | C23 | H233 | 60.0° | 150.0° |
C21 | C22 | C23 | H232 | 60.0° | 30.0° |
C21 | C22 | C24 | H241 | 179.3° | 173.6° |
C29 | C30 | O31 | H301 | 120.4° | 120.0° |
C29 | C30 | O31 | H302 | 120.4° | 119.9° |
C29 | C30 | O31 | P32 | 92.4° | 180.0° |
C29 | C30 | H301 | H302 | 118.9° | 120.0° |
C25 | C24 | C22 | H241 | 180.0° | 179.9° |
C25 | C24 | C22 | C23 | 179.5° | 173.5° |
C24 | C25 | H252 | H251 | 117.8° | 120.0° |
C24 | C25 | C26 | H261 | 60.0° | 60.1° |
C24 | C25 | C26 | H262 | 58.1° | 60.0° |
O35 | P36 | O39 | C40 | 97.1° | 175.0° |
P36 | O35 | P32 | O31 | 129.7° | 165.0° |
P36 | O35 | P32 | O34 | 13.1° | 45.0° |
P36 | O35 | P32 | O33 | 112.6° | 75.1° |
O35 | P36 | O38 | H2 | 133.5° | 60.0° |
O39 | P36 | O35 | P32 | 61.4° | 160.0° |
P36 | O39 | C40 | C49 | 41.0° | 150.0° |
P36 | O39 | C40 | O41 | 163.9° | 90.1° |
P36 | O39 | C40 | H401 | 76.6° | 29.9° |
O39 | P36 | O38 | H2 | 108.9° | 60.0° |
C24 | C22 | C21 | H211 | 176.4° | 145.9° |
C24 | C22 | C21 | H212 | 58.7° | 26.0° |
C24 | C22 | C23 | H231 | 1.2° | 90.0° |
C24 | C22 | C23 | H233 | 121.2° | 30.0° |
C24 | C22 | C23 | H232 | 118.8° | 150.0° |
C22 | C24 | C25 | H252 | 32.1° | 113.6° |
C22 | C24 | C25 | H251 | 86.5° | 6.4° |
C23 | C22 | C21 | H211 | 2.4° | 34.1° |
C23 | C22 | C21 | H212 | 120.1° | 154.1° |
C22 | C23 | H231 | H233 | 120.0° | 120.0° |
C22 | C23 | H231 | H232 | 120.0° | 120.0° |
C22 | C23 | H233 | H232 | 120.0° | 120.0° |
C23 | C22 | C24 | H241 | 0.5° | 6.5° |
C30 | O31 | P32 | O35 | 57.8° | 175.0° |
C30 | O31 | P32 | O34 | 62.8° | 55.0° |
C30 | O31 | P32 | O33 | 178.3° | 65.0° |
O31 | C30 | C29 | H291 | 42.9° | 44.4° |
O31 | C30 | H301 | H302 | 118.9° | 120.0° |
O35 | P32 | O31 | O34 | 120.6° | 120.0° |
O35 | P32 | O31 | O33 | 123.9° | 120.0° |
O35 | P32 | O34 | O33 | 128.2° | 120.0° |
O35 | P32 | O33 | H1 | 126.4° | 60.0° |
O39 | C40 | C49 | O41 | 123.6° | 120.0° |
O39 | C40 | C49 | H401 | 119.7° | 120.1° |
O39 | C40 | O41 | H401 | 120.3° | 120.0° |
O39 | C40 | C49 | C47 | 161.4° | 62.4° |
O39 | C40 | C49 | N50 | 38.9° | 57.6° |
O39 | C40 | O41 | C42 | 167.4° | 58.8° |
O39 | C40 | C49 | H491 | 81.6° | 177.7° |
C49 | C40 | O41 | H401 | 115.1° | 120.0° |
C40 | C49 | C47 | O48 | 140.3° | 176.9° |
C40 | C49 | C47 | N50 | 122.5° | 119.9° |
C40 | C49 | C47 | H491 | 116.1° | 119.9° |
C40 | C49 | N50 | H491 | 119.6° | 120.1° |
C40 | C49 | C47 | C45 | 24.5° | 57.0° |
C40 | C49 | N50 | C51 | 164.8° | 85.0° |
C49 | C40 | O41 | C42 | 67.9° | 61.1° |
C40 | C49 | C47 | H471 | 97.8° | 62.9° |
C40 | C49 | N50 | H501 | 15.2° | 95.1° |
O41 | C40 | C49 | C47 | 37.8° | 57.6° |
O41 | C40 | C49 | N50 | 84.6° | 177.5° |
C40 | O41 | C42 | C45 | 22.1° | 61.1° |
C40 | O41 | C42 | C43 | 94.6° | 178.9° |
C40 | O41 | C42 | H421 | 141.5° | 58.8° |
O41 | C40 | C49 | H491 | 154.8° | 62.3° |
O48 | C47 | C49 | C45 | 115.8° | 119.9° |
O48 | C47 | C49 | H471 | 121.8° | 120.2° |
O48 | C47 | C49 | N50 | 97.2° | 63.2° |
O48 | C47 | C45 | H471 | 122.9° | 120.1° |
O48 | C47 | C45 | O46 | 60.0° | 63.2° |
O48 | C47 | C45 | C42 | 175.9° | 177.0° |
O48 | C47 | C45 | H451 | 63.6° | 57.1° |
O48 | C47 | C49 | H491 | 24.2° | 57.0° |
C47 | C49 | N50 | H491 | 121.1° | 120.2° |
C49 | C47 | C45 | H471 | 122.4° | 119.9° |
C49 | C47 | C45 | O46 | 174.7° | 176.9° |
C49 | C47 | C45 | C42 | 69.5° | 57.0° |
C47 | C49 | N50 | C51 | 45.5° | 155.3° |
C47 | C49 | C40 | H401 | 78.8° | 177.6° |
C49 | C47 | C45 | H451 | 51.1° | 62.9° |
C47 | C49 | N50 | H501 | 134.5° | 24.6° |
C49 | C47 | O48 | H481 | 66.6° | 179.6° |
N50 | C49 | C47 | C45 | 147.0° | 176.9° |
C49 | N50 | C51 | H501 | 180.0° | 179.9° |
C49 | N50 | C51 | O53 | 0.3° | 0.1° |
C49 | N50 | C51 | C52 | 179.8° | 180.0° |
N50 | C49 | C40 | H401 | 158.7° | 62.5° |
N50 | C49 | C47 | H471 | 24.6° | 57.0° |
C47 | C45 | O46 | C42 | 116.5° | 119.7° |
C47 | C45 | O46 | H451 | 122.3° | 120.2° |
C47 | C45 | C42 | H451 | 121.1° | 119.9° |
C47 | C45 | C42 | C43 | 165.2° | 177.6° |
C47 | C45 | C42 | O41 | 45.3° | 57.6° |
C47 | C45 | C42 | H421 | 75.9° | 62.4° |
C45 | C47 | C49 | H491 | 91.6° | 62.9° |
C47 | C45 | O46 | H461 | 180.0° | 180.0° |
C45 | C47 | O48 | H481 | 175.5° | 60.0° |
O46 | C45 | C42 | H451 | 123.0° | 120.2° |
O46 | C45 | C42 | C43 | 78.9° | 62.5° |
O46 | C45 | C42 | O41 | 161.3° | 177.5° |
O46 | C45 | C42 | H421 | 40.0° | 57.6° |
O46 | C45 | C47 | H471 | 62.9° | 56.9° |
C45 | C42 | C43 | O44 | 151.4° | 175.0° |
C45 | C42 | C43 | O41 | 116.0° | 120.0° |
C45 | C42 | C43 | H421 | 118.7° | 120.0° |
C45 | C42 | O41 | H421 | 119.4° | 120.0° |
C45 | C42 | C43 | H431 | 31.4° | 55.0° |
C45 | C42 | C43 | H432 | 88.7° | 65.0° |
C42 | C45 | C47 | H471 | 53.0° | 62.9° |
C42 | C45 | O46 | H461 | 63.5° | 60.3° |
O44 | C43 | C42 | H431 | 119.9° | 120.0° |
O44 | C43 | C42 | H432 | 119.9° | 120.0° |
O44 | C43 | C42 | O41 | 35.4° | 65.0° |
O44 | C43 | C42 | H421 | 90.0° | 55.0° |
O44 | C43 | H431 | H432 | 120.3° | 120.1° |
C43 | C42 | O41 | H421 | 123.9° | 120.0° |
C42 | C43 | H431 | H432 | 120.3° | 120.0° |
C43 | C42 | C45 | H451 | 44.1° | 57.7° |
C42 | C43 | O44 | H441 | 180.0° | 180.0° |
O31 | P32 | O34 | O33 | 111.4° | 120.1° |
P32 | O31 | C30 | H301 | 28.0° | 60.0° |
P32 | O31 | C30 | H302 | 147.3° | 60.0° |
O31 | P32 | O33 | H1 | 111.9° | 60.0° |
N50 | C51 | O53 | C52 | 179.9° | 179.9° |
C51 | N50 | C49 | H491 | 75.6° | 35.1° |
N50 | C51 | C52 | H522 | 179.9° | 0.0° |
N50 | C51 | C52 | H523 | 59.9° | 119.9° |
N50 | C51 | C52 | H521 | 60.1° | 120.0° |
O34 | P32 | O33 | H1 | 0.0° | 180.0° |
C42 | O41 | C40 | H401 | 47.1° | 178.9° |
O41 | C42 | C43 | H431 | 84.5° | 175.0° |
O41 | C42 | C43 | H432 | 155.3° | 55.0° |
O41 | C42 | C45 | H451 | 75.7° | 62.3° |
O53 | C51 | C52 | H522 | 0.0° | 180.0° |
O53 | C51 | C52 | H523 | 120.0° | 60.0° |
O53 | C51 | C52 | H521 | 120.0° | 60.1° |
O53 | C51 | N50 | H501 | 179.7° | 180.0° |
C51 | C52 | H522 | H523 | 120.0° | 120.0° |
C51 | C52 | H522 | H521 | 120.0° | 120.0° |
C51 | C52 | H523 | H521 | 120.0° | 120.0° |
C52 | C51 | N50 | H501 | 0.2° | 0.1° |
H013 | C01 | H012 | H011 | 120.0° | 120.0° |
H033 | C03 | H032 | H031 | 120.0° | 120.0° |
H041 | C04 | C05 | H051 | 28.0° | 60.0° |
H041 | C04 | C05 | H052 | 145.1° | 180.0° |
H051 | C05 | C06 | H061 | 121.7° | 180.0° |
H051 | C05 | C06 | H062 | 120.8° | 60.1° |
H052 | C05 | C06 | H061 | 4.6° | 60.1° |
H052 | C05 | C06 | H062 | 122.1° | NaN° |
H081 | C08 | H083 | H082 | 120.0° | 120.0° |
H091 | C09 | C10 | H101 | 174.9° | 60.0° |
H091 | C09 | C10 | H102 | 65.8° | 180.0° |
H101 | C10 | C11 | H111 | 138.5° | 180.0° |
H101 | C10 | C11 | H112 | 19.7° | 60.0° |
H102 | C10 | C11 | H111 | 19.2° | 60.0° |
H102 | C10 | C11 | H112 | 99.6° | 180.0° |
H133 | C13 | H132 | H131 | 120.0° | 120.0° |
H141 | C14 | C15 | H152 | 126.0° | 59.8° |
H141 | C14 | C15 | H151 | 115.8° | 179.8° |
H152 | C15 | C16 | H162 | 152.7° | 180.0° |
H152 | C15 | C16 | H161 | 34.4° | 60.0° |
H151 | C15 | C16 | H162 | 34.5° | 60.0° |
H151 | C15 | C16 | H161 | 83.8° | 180.0° |
H183 | C18 | H181 | H182 | 120.0° | 120.1° |
H191 | C19 | C20 | H202 | 174.5° | 62.6° |
H191 | C19 | C20 | H201 | 56.9° | 177.5° |
H202 | C20 | C21 | H211 | 80.3° | 180.0° |
H202 | C20 | C21 | H212 | 37.3° | 60.0° |
H201 | C20 | C21 | H211 | 162.0° | 60.0° |
H201 | C20 | C21 | H212 | 80.3° | 180.0° |
H231 | C23 | H233 | H232 | 120.0° | 120.0° |
H241 | C24 | C25 | H252 | 147.9° | 66.4° |
H241 | C24 | C25 | H251 | 93.5° | 173.5° |
H252 | C25 | C26 | H261 | 179.2° | 180.0° |
H252 | C25 | C26 | H262 | 62.6° | 59.9° |
H251 | C25 | C26 | H261 | 60.6° | 59.9° |
H251 | C25 | C26 | H262 | 178.8° | 180.0° |
H282 | C28 | H281 | H283 | 120.0° | 120.0° |
H291 | C29 | C30 | H301 | 77.4° | 75.7° |
H291 | C29 | C30 | H302 | 163.3° | 164.3° |
H401 | C40 | C49 | H491 | 38.1° | 57.6° |
H421 | C42 | C43 | H431 | 150.1° | 65.0° |
H421 | C42 | C43 | H432 | 30.0° | 175.0° |
H421 | C42 | C45 | H451 | 163.0° | 177.7° |
H431 | C43 | O44 | H441 | 60.1° | 60.0° |
H432 | C43 | O44 | H441 | 60.1° | 60.0° |
H451 | C45 | C47 | H471 | 173.5° | 177.2° |
H451 | C45 | O46 | H461 | 57.7° | 59.8° |
H471 | C47 | C49 | H491 | 146.0° | 177.2° |
H471 | C47 | O48 | H481 | 53.9° | 60.1° |
H491 | C49 | N50 | H501 | 104.4° | 144.8° |
H522 | C52 | H523 | H521 | 120.0° | 120.0° |