GET
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C11 | O11 | sing | 1.43Å | 1.40Å | |
C11 | C21 | sing | 1.53Å | 1.55Å | |
C11 | O51 | sing | 1.43Å | 1.47Å | |
C11 | H111 | sing | 1.09Å | 1.11Å | |
O11 | C42 | sing | 1.43Å | 1.43Å | |
C21 | N21 | sing | 1.47Å | 1.48Å | |
C21 | C31 | sing | 1.53Å | 1.56Å | |
C21 | H21 | sing | 1.09Å | 1.12Å | |
N21 | H211 | sing | 1.01Å | 1.02Å | |
N21 | H212 | sing | 1.01Å | 1.02Å | |
C31 | O31 | sing | 1.43Å | 1.36Å | |
C31 | C41 | sing | 1.53Å | 1.55Å | |
C31 | H311 | sing | 1.09Å | 1.11Å | |
O31 | H31 | sing | 0.97Å | 0.95Å | |
C41 | O41 | sing | 1.43Å | 1.43Å | |
C41 | C51 | sing | 1.53Å | 1.56Å | |
C41 | H411 | sing | 1.09Å | 1.12Å | |
O41 | H41 | sing | 0.97Å | 0.95Å | |
C51 | O51 | sing | 1.43Å | 1.47Å | |
C51 | C61 | sing | 1.53Å | 1.54Å | |
C51 | H511 | sing | 1.09Å | 1.11Å | |
C61 | O61 | sing | 1.43Å | 1.39Å | |
C61 | C71 | sing | 1.53Å | 1.55Å | |
C61 | H611 | sing | 1.09Å | 1.12Å | |
O61 | H61 | sing | 0.97Å | 0.95Å | |
C71 | H711 | sing | 1.09Å | 1.11Å | |
C71 | H712 | sing | 1.09Å | 1.12Å | |
C71 | H713 | sing | 1.09Å | 1.11Å | |
C12 | N12 | sing | 1.47Å | 1.48Å | |
C12 | C22 | sing | 1.53Å | 1.55Å | |
C12 | C62 | sing | 1.53Å | 1.55Å | |
C12 | H12 | sing | 1.09Å | 1.12Å | |
N12 | H121 | sing | 1.01Å | 1.02Å | |
N12 | H122 | sing | 1.01Å | 1.02Å | |
C22 | C32 | sing | 1.53Å | 1.55Å | |
C22 | H221 | sing | 1.09Å | 1.11Å | |
C22 | H222 | sing | 1.09Å | 1.11Å | |
C32 | N32 | sing | 1.47Å | 1.48Å | |
C32 | C42 | sing | 1.53Å | 1.56Å | |
C32 | H32 | sing | 1.09Å | 1.12Å | |
N32 | H321 | sing | 1.01Å | 1.02Å | |
N32 | H322 | sing | 1.01Å | 1.02Å | |
C42 | C52 | sing | 1.53Å | 1.55Å | |
C42 | H421 | sing | 1.09Å | 1.12Å | |
C52 | O52 | sing | 1.43Å | 1.41Å | |
C52 | C62 | sing | 1.53Å | 1.54Å | |
C52 | H521 | sing | 1.09Å | 1.11Å | |
O52 | H52 | sing | 0.97Å | 0.95Å | |
C62 | O62 | sing | 1.43Å | 1.42Å | |
C62 | H621 | sing | 1.09Å | 1.11Å | |
O62 | C13 | sing | 1.43Å | 1.41Å | |
C13 | C23 | sing | 1.53Å | 1.55Å | |
C13 | O53 | sing | 1.43Å | 1.47Å | |
C13 | H131 | sing | 1.09Å | 1.11Å | |
C23 | O23 | sing | 1.43Å | 1.42Å | |
C23 | C33 | sing | 1.53Å | 1.57Å | |
C23 | H231 | sing | 1.09Å | 1.11Å | |
O23 | H23 | sing | 0.97Å | 0.95Å | |
C33 | N33 | sing | 1.47Å | 1.50Å | |
C33 | C43 | sing | 1.53Å | 1.56Å | |
C33 | H331 | sing | 1.09Å | 1.11Å | |
N33 | C93 | sing | 1.47Å | 1.48Å | |
N33 | H33 | sing | 1.01Å | 1.02Å | |
C93 | H931 | sing | 1.09Å | 1.11Å | |
C93 | H932 | sing | 1.09Å | 1.12Å | |
C93 | H933 | sing | 1.09Å | 1.11Å | |
C43 | O43 | sing | 1.43Å | 1.43Å | |
C43 | C83 | sing | 1.53Å | 1.43Å | |
C43 | C53 | sing | 1.53Å | 1.55Å | |
O43 | H43 | sing | 0.97Å | 0.95Å | |
C83 | H831 | sing | 1.09Å | 1.11Å | |
C83 | H832 | sing | 1.09Å | 1.12Å | |
C83 | H833 | sing | 1.09Å | 1.11Å | |
C53 | O53 | sing | 1.43Å | 1.48Å | |
C53 | H531 | sing | 1.09Å | 1.12Å | |
C53 | H532 | sing | 1.09Å | 1.12Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O11 | C11 | C21 | 107.2° | 109.5° |
O11 | C11 | O51 | 111.0° | 109.4° |
O11 | C11 | H111 | 110.5° | 109.4° |
C11 | O11 | C42 | 120.7° | 106.8° |
C21 | C11 | O51 | 111.1° | 109.7° |
C21 | C11 | H111 | 110.4° | 109.4° |
C11 | C21 | N21 | 110.2° | 109.6° |
C11 | C21 | C31 | 110.2° | 109.1° |
C11 | C21 | H21 | 109.2° | 109.7° |
O51 | C11 | H111 | 106.6° | 109.4° |
C11 | O51 | C51 | 114.7° | 107.6° |
O11 | C42 | C32 | 108.2° | 109.4° |
O11 | C42 | C52 | 110.1° | 109.5° |
O11 | C42 | H421 | 109.9° | 109.5° |
N21 | C21 | C31 | 111.5° | 109.5° |
N21 | C21 | H21 | 107.9° | 109.5° |
C21 | N21 | H211 | 110.2° | 106.7° |
C21 | N21 | H212 | 111.9° | 106.8° |
C31 | C21 | H21 | 107.8° | 109.5° |
C21 | C31 | O31 | 111.3° | 109.8° |
C21 | C31 | C41 | 108.5° | 108.6° |
C21 | C31 | H311 | 109.4° | 109.6° |
H211 | N21 | H212 | 111.9° | 106.7° |
O31 | C31 | C41 | 110.7° | 109.6° |
O31 | C31 | H311 | 107.0° | 109.7° |
C31 | O31 | H31 | 111.3° | 106.8° |
C41 | C31 | H311 | 109.9° | 109.5° |
C31 | C41 | O41 | 110.4° | 109.7° |
C31 | C41 | C51 | 109.4° | 109.0° |
C31 | C41 | H411 | 109.3° | 109.5° |
O41 | C41 | C51 | 110.7° | 109.6° |
O41 | C41 | H411 | 107.9° | 109.6° |
C41 | O41 | H41 | 110.4° | 106.7° |
C51 | C41 | H411 | 109.0° | 109.5° |
C41 | C51 | O51 | 110.5° | 109.9° |
C41 | C51 | C61 | 113.5° | 109.3° |
C41 | C51 | H511 | 105.5° | 109.4° |
O51 | C51 | C61 | 108.1° | 109.4° |
O51 | C51 | H511 | 111.2° | 109.4° |
C61 | C51 | H511 | 108.0° | 109.4° |
C51 | C61 | O61 | 110.6° | 109.5° |
C51 | C61 | C71 | 113.2° | 109.5° |
C51 | C61 | H611 | 105.5° | 109.5° |
O61 | C61 | C71 | 107.3° | 109.4° |
O61 | C61 | H611 | 111.6° | 109.5° |
C61 | O61 | H61 | 110.5° | 106.8° |
C71 | C61 | H611 | 108.8° | 109.5° |
C61 | C71 | H711 | 113.2° | 109.5° |
C61 | C71 | H712 | 110.9° | 109.5° |
C61 | C71 | H713 | 110.9° | 109.5° |
H711 | C71 | H712 | 110.8° | 109.4° |
H711 | C71 | H713 | 110.9° | 109.5° |
H712 | C71 | H713 | 99.4° | 109.4° |
N12 | C12 | C22 | 109.8° | 109.5° |
N12 | C12 | C62 | 110.3° | 109.5° |
N12 | C12 | H12 | 108.8° | 109.5° |
C12 | N12 | H121 | 109.8° | 106.7° |
C12 | N12 | H122 | 112.0° | 106.7° |
C22 | C12 | C62 | 109.8° | 109.5° |
C22 | C12 | H12 | 109.3° | 109.4° |
C12 | C22 | C32 | 110.3° | 109.5° |
C12 | C22 | H221 | 111.9° | 109.5° |
C12 | C22 | H222 | 111.9° | 109.5° |
C62 | C12 | H12 | 108.8° | 109.4° |
C12 | C62 | C52 | 109.9° | 109.5° |
C12 | C62 | O62 | 109.6° | 109.5° |
C12 | C62 | H621 | 109.0° | 109.4° |
H121 | N12 | H122 | 112.1° | 106.8° |
C32 | C22 | H221 | 111.9° | 109.4° |
C32 | C22 | H222 | 111.8° | 109.5° |
C22 | C32 | N32 | 108.6° | 109.5° |
C22 | C32 | C42 | 109.8° | 109.5° |
C22 | C32 | H32 | 110.6° | 109.4° |
H221 | C22 | H222 | 98.5° | 109.4° |
N32 | C32 | C42 | 111.6° | 109.5° |
N32 | C32 | H32 | 108.7° | 109.5° |
C32 | N32 | H321 | 108.6° | 106.7° |
C32 | N32 | H322 | 112.5° | 106.7° |
C42 | C32 | H32 | 107.5° | 109.4° |
C32 | C42 | C52 | 109.7° | 109.5° |
C32 | C42 | H421 | 110.4° | 109.4° |
H321 | N32 | H322 | 112.5° | 106.7° |
C52 | C42 | H421 | 108.5° | 109.5° |
C42 | C52 | O52 | 109.5° | 109.5° |
C42 | C52 | C62 | 109.5° | 109.4° |
C42 | C52 | H521 | 109.2° | 109.5° |
O52 | C52 | C62 | 109.0° | 109.4° |
O52 | C52 | H521 | 109.8° | 109.5° |
C52 | O52 | H52 | 109.5° | 106.8° |
C62 | C52 | H521 | 109.8° | 109.4° |
C52 | C62 | O62 | 109.2° | 109.5° |
C52 | C62 | H621 | 109.3° | 109.5° |
O62 | C62 | H621 | 109.7° | 109.5° |
C62 | O62 | C13 | 117.2° | 106.8° |
O62 | C13 | C23 | 108.6° | 109.4° |
O62 | C13 | O53 | 109.4° | 109.3° |
O62 | C13 | H131 | 110.2° | 109.5° |
C23 | C13 | O53 | 109.9° | 109.8° |
C23 | C13 | H131 | 109.8° | 109.4° |
C13 | C23 | O23 | 109.5° | 109.6° |
C13 | C23 | C33 | 108.7° | 109.0° |
C13 | C23 | H231 | 110.6° | 109.6° |
O53 | C13 | H131 | 108.9° | 109.4° |
C13 | O53 | C53 | 114.7° | 107.6° |
O23 | C23 | C33 | 111.3° | 109.6° |
O23 | C23 | H231 | 108.0° | 109.5° |
C23 | O23 | H23 | 109.5° | 106.8° |
C33 | C23 | H231 | 108.8° | 109.5° |
C23 | C33 | N33 | 112.9° | 109.6° |
C23 | C33 | C43 | 108.8° | 108.9° |
C23 | C33 | H331 | 107.7° | 109.5° |
N33 | C33 | C43 | 109.8° | 109.6° |
N33 | C33 | H331 | 106.6° | 109.6° |
C33 | N33 | C93 | 110.5° | 106.7° |
C33 | N33 | H33 | 111.8° | 106.6° |
C43 | C33 | H331 | 110.9° | 109.7° |
C33 | C43 | O43 | 109.0° | 109.4° |
C33 | C43 | C83 | 112.4° | 109.8° |
C33 | C43 | C53 | 110.7° | 109.0° |
C93 | N33 | H33 | 111.8° | 106.7° |
N33 | C93 | H931 | 110.5° | 109.5° |
N33 | C93 | H932 | 111.8° | 109.5° |
N33 | C93 | H933 | 111.8° | 109.5° |
H931 | C93 | H932 | 111.8° | 109.4° |
H931 | C93 | H933 | 111.9° | 109.5° |
H932 | C93 | H933 | 98.5° | 109.5° |
O43 | C43 | C83 | 107.4° | 109.6° |
O43 | C43 | C53 | 107.0° | 109.5° |
C43 | O43 | H43 | 109.0° | 106.8° |
C83 | C43 | C53 | 110.1° | 109.5° |
C43 | C83 | H831 | 112.4° | 109.5° |
C43 | C83 | H832 | 111.1° | 109.5° |
C43 | C83 | H833 | 111.1° | 109.5° |
C43 | C53 | O53 | 110.3° | 109.9° |
C43 | C53 | H531 | 111.9° | 109.4° |
C43 | C53 | H532 | 111.9° | 109.3° |
H831 | C83 | H832 | 111.1° | 109.5° |
H831 | C83 | H833 | 111.1° | 109.5° |
H832 | C83 | H833 | 99.2° | 109.5° |
O53 | C53 | H531 | 111.9° | 109.4° |
O53 | C53 | H532 | 111.9° | 109.4° |
H531 | C53 | H532 | 98.5° | 109.4° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O11 | C11 | C21 | O51 | 121.5° | 120.1° |
O11 | C11 | C21 | H111 | 120.5° | 119.9° |
O11 | C11 | O51 | H111 | 120.4° | 119.9° |
O11 | C11 | C21 | N21 | 57.1° | 61.1° |
O11 | C11 | C21 | C31 | 66.4° | 58.7° |
O11 | C11 | C21 | H21 | 175.4° | 178.7° |
O11 | C11 | O51 | C51 | 63.6° | 52.5° |
C11 | O11 | C42 | C32 | 158.3° | 151.0° |
C11 | O11 | C42 | C52 | 81.8° | 89.0° |
C11 | O11 | C42 | H421 | 37.7° | 31.1° |
C21 | C11 | O51 | H111 | 120.3° | 120.0° |
C21 | C11 | O11 | C42 | 150.2° | 164.5° |
C11 | C21 | N21 | C31 | 122.7° | 119.6° |
C11 | C21 | N21 | H21 | 119.1° | 120.3° |
C11 | C21 | C31 | H21 | 119.0° | 120.0° |
C11 | C21 | N21 | H211 | 180.0° | 60.4° |
C11 | C21 | N21 | H212 | 54.8° | 174.2° |
C11 | C21 | C31 | O31 | 179.4° | 173.6° |
C11 | C21 | C31 | C41 | 57.3° | 53.8° |
C11 | C21 | C31 | H311 | 62.6° | 65.9° |
C21 | C11 | O51 | C51 | 55.7° | 67.6° |
O51 | C11 | O11 | C42 | 88.2° | 75.3° |
O51 | C11 | C21 | N21 | 178.5° | 178.8° |
O51 | C11 | C21 | C31 | 55.1° | 61.4° |
O51 | C11 | C21 | H21 | 63.1° | 58.6° |
C11 | O51 | C51 | C41 | 56.7° | 67.6° |
C11 | O51 | C51 | C61 | 178.6° | 172.3° |
C11 | O51 | C51 | H511 | 60.2° | 52.5° |
H111 | C11 | O11 | C42 | 29.8° | 44.6° |
H111 | C11 | C21 | N21 | 63.4° | 58.8° |
H111 | C11 | C21 | C31 | 173.1° | 178.6° |
H111 | C11 | C21 | H21 | 54.9° | 61.4° |
H111 | C11 | O51 | C51 | 176.0° | 172.4° |
O11 | C42 | C32 | C22 | 178.9° | 180.0° |
O11 | C42 | C32 | N32 | 60.5° | 60.0° |
O11 | C42 | C32 | C52 | 120.1° | 120.0° |
O11 | C42 | C32 | H421 | 120.3° | 120.0° |
O11 | C42 | C32 | H32 | 58.6° | 60.0° |
O11 | C42 | C52 | H421 | 120.3° | 120.0° |
O11 | C42 | C52 | O52 | 61.7° | 60.0° |
O11 | C42 | C52 | C62 | 178.9° | 180.0° |
O11 | C42 | C52 | H521 | 58.6° | 60.0° |
N21 | C21 | C31 | H21 | 118.2° | 120.1° |
C21 | N21 | H211 | H212 | 125.2° | 113.8° |
N21 | C21 | C31 | O31 | 57.8° | 66.5° |
N21 | C21 | C31 | C41 | 180.0° | 173.7° |
N21 | C21 | C31 | H311 | 60.2° | 54.0° |
C31 | C21 | N21 | H211 | 57.3° | 180.0° |
C31 | C21 | N21 | H212 | 177.5° | 66.2° |
C21 | C31 | O31 | C41 | 120.8° | 119.2° |
C21 | C31 | O31 | H311 | 119.5° | 120.5° |
C21 | C31 | C41 | H311 | 119.6° | 119.7° |
C21 | C31 | O31 | H31 | 180.0° | 179.2° |
C21 | C31 | C41 | O41 | 179.8° | 173.6° |
C21 | C31 | C41 | C51 | 58.1° | 53.6° |
C21 | C31 | C41 | H411 | 61.2° | 66.1° |
H21 | C21 | N21 | H211 | 60.9° | 59.9° |
H21 | C21 | N21 | H212 | 64.3° | 53.9° |
H21 | C21 | C31 | O31 | 60.4° | 53.6° |
H21 | C21 | C31 | C41 | 61.7° | 66.2° |
H21 | C21 | C31 | H311 | 178.4° | 174.1° |
O31 | C31 | C41 | H311 | 118.0° | 120.4° |
O31 | C31 | C41 | O41 | 57.3° | 66.4° |
O31 | C31 | C41 | C51 | 179.4° | 173.6° |
O31 | C31 | C41 | H411 | 61.2° | 53.8° |
C41 | C31 | O31 | H31 | 59.2° | 60.0° |
C31 | C41 | O41 | C51 | 121.3° | 119.6° |
C31 | C41 | O41 | H411 | 119.4° | 120.2° |
C31 | C41 | C51 | H411 | 119.5° | 119.7° |
C31 | C41 | O41 | H41 | 180.0° | 60.4° |
C31 | C41 | C51 | O51 | 57.4° | 61.2° |
C31 | C41 | C51 | C61 | 179.1° | 178.7° |
C31 | C41 | C51 | H511 | 62.9° | 58.9° |
H311 | C31 | O31 | H31 | 60.6° | 60.3° |
H311 | C31 | C41 | O41 | 60.6° | 53.9° |
H311 | C31 | C41 | C51 | 61.4° | 66.1° |
H311 | C31 | C41 | H411 | 179.2° | 174.2° |
O41 | C41 | C51 | H411 | 118.6° | 120.2° |
O41 | C41 | C51 | O51 | 179.3° | 178.8° |
O41 | C41 | C51 | C61 | 59.0° | 58.7° |
O41 | C41 | C51 | H511 | 59.0° | 61.1° |
C51 | C41 | O41 | H41 | 58.7° | 180.0° |
C41 | C51 | O51 | C61 | 124.8° | 120.0° |
C41 | C51 | O51 | H511 | 116.8° | 120.1° |
C41 | C51 | C61 | H511 | 116.6° | 119.8° |
C41 | C51 | C61 | O61 | 177.3° | 59.7° |
C41 | C51 | C61 | C71 | 62.3° | 179.6° |
C41 | C51 | C61 | H611 | 56.6° | 60.3° |
H411 | C41 | O41 | H41 | 60.5° | 59.8° |
H411 | C41 | C51 | O51 | 62.1° | 58.5° |
H411 | C41 | C51 | C61 | 59.5° | 61.5° |
H411 | C41 | C51 | H511 | 177.6° | 178.6° |
O51 | C51 | C61 | H511 | 120.4° | 119.8° |
O51 | C51 | C61 | O61 | 59.7° | 179.9° |
O51 | C51 | C61 | C71 | 60.7° | 60.0° |
O51 | C51 | C61 | H611 | 179.5° | 60.0° |
C51 | C61 | O61 | C71 | 123.9° | 120.0° |
C51 | C61 | O61 | H611 | 117.1° | 120.0° |
C51 | C61 | C71 | H611 | 116.9° | 120.0° |
C51 | C61 | O61 | H61 | 180.0° | 60.0° |
C51 | C61 | C71 | H711 | 180.0° | 180.0° |
C51 | C61 | C71 | H712 | 54.7° | 60.0° |
C51 | C61 | C71 | H713 | 54.7° | 59.9° |
H511 | C51 | C61 | O61 | 60.7° | 60.1° |
H511 | C51 | C61 | C71 | 178.9° | 59.8° |
H511 | C51 | C61 | H611 | 60.1° | 179.8° |
O61 | C61 | C71 | H611 | 120.8° | 120.0° |
O61 | C61 | C71 | H711 | 57.8° | 60.1° |
O61 | C61 | C71 | H712 | 177.0° | 180.0° |
O61 | C61 | C71 | H713 | 67.6° | 60.0° |
C71 | C61 | O61 | H61 | 56.1° | 60.0° |
C61 | C71 | H711 | H712 | 125.3° | 120.0° |
C61 | C71 | H711 | H713 | 125.3° | 120.1° |
C61 | C71 | H712 | H713 | 116.7° | 120.0° |
H611 | C61 | O61 | H61 | 62.9° | 180.0° |
H611 | C61 | C71 | H711 | 63.1° | 60.0° |
H611 | C61 | C71 | H712 | 62.2° | 60.0° |
H611 | C61 | C71 | H713 | 171.6° | 180.0° |
H711 | C71 | H712 | H713 | 116.7° | 120.0° |
N12 | C12 | C22 | C62 | 121.4° | 120.0° |
N12 | C12 | C22 | H12 | 119.3° | 120.0° |
N12 | C12 | C62 | H12 | 119.3° | 120.0° |
C12 | N12 | H121 | H122 | 125.2° | 113.8° |
N12 | C12 | C22 | C32 | 179.7° | 180.0° |
N12 | C12 | C22 | H221 | 54.4° | 60.0° |
N12 | C12 | C22 | H222 | 55.1° | 60.0° |
N12 | C12 | C62 | C52 | 179.6° | 180.0° |
N12 | C12 | C62 | O62 | 59.6° | 60.0° |
N12 | C12 | C62 | H621 | 60.5° | 60.0° |
C22 | C12 | C62 | H12 | 119.6° | 120.0° |
C22 | C12 | N12 | H121 | 180.0° | 60.0° |
C22 | C12 | N12 | H122 | 54.7° | 53.8° |
C12 | C22 | C32 | H221 | 125.3° | 120.0° |
C12 | C22 | C32 | H222 | 125.3° | 120.1° |
C12 | C22 | H221 | H222 | 117.9° | 120.0° |
C12 | C22 | C32 | N32 | 179.6° | 180.0° |
C12 | C22 | C32 | C42 | 58.1° | 59.9° |
C12 | C22 | C32 | H32 | 60.4° | 60.0° |
C22 | C12 | C62 | C52 | 59.3° | 59.9° |
C22 | C12 | C62 | O62 | 179.3° | 180.0° |
C22 | C12 | C62 | H621 | 60.6° | 60.0° |
C62 | C12 | N12 | H121 | 58.9° | 179.9° |
C62 | C12 | N12 | H122 | 66.4° | 66.2° |
C62 | C12 | C22 | C32 | 58.3° | 59.9° |
C62 | C12 | C22 | H221 | 67.0° | 60.0° |
C62 | C12 | C22 | H222 | 176.5° | 180.0° |
C12 | C62 | C52 | C42 | 60.2° | 60.0° |
C12 | C62 | C52 | O52 | 180.0° | 180.0° |
C12 | C62 | C52 | O62 | 120.3° | 120.1° |
C12 | C62 | C52 | H621 | 119.6° | 119.9° |
C12 | C62 | C52 | H521 | 59.7° | 60.0° |
C12 | C62 | O62 | H621 | 119.7° | 120.0° |
C12 | C62 | O62 | C13 | 109.4° | 87.9° |
H12 | C12 | N12 | H121 | 60.4° | 60.0° |
H12 | C12 | N12 | H122 | 174.3° | 173.8° |
H12 | C12 | C22 | C32 | 61.0° | 60.0° |
H12 | C12 | C22 | H221 | 173.7° | 180.0° |
H12 | C12 | C22 | H222 | 64.2° | 60.0° |
H12 | C12 | C62 | C52 | 60.3° | 60.0° |
H12 | C12 | C62 | O62 | 59.7° | 60.0° |
H12 | C12 | C62 | H621 | 179.9° | 180.0° |
C32 | C22 | H221 | H222 | 117.8° | 120.0° |
C22 | C32 | N32 | C42 | 121.2° | 120.0° |
C22 | C32 | N32 | H32 | 120.4° | 120.0° |
C22 | C32 | C42 | H32 | 120.4° | 120.0° |
C22 | C32 | N32 | H321 | 180.0° | 52.8° |
C22 | C32 | N32 | H322 | 54.7° | 166.6° |
C22 | C32 | C42 | C52 | 58.8° | 60.0° |
C22 | C32 | C42 | H421 | 60.7° | 60.1° |
H221 | C22 | C32 | N32 | 55.1° | 60.0° |
H221 | C22 | C32 | C42 | 67.2° | 60.1° |
H221 | C22 | C32 | H32 | 174.3° | 180.0° |
H222 | C22 | C32 | N32 | 54.4° | 59.9° |
H222 | C22 | C32 | C42 | 176.6° | 180.0° |
H222 | C22 | C32 | H32 | 64.8° | 60.0° |
N32 | C32 | C42 | H32 | 119.1° | 120.0° |
C32 | N32 | H321 | H322 | 125.3° | 113.8° |
N32 | C32 | C42 | C52 | 179.3° | 180.0° |
N32 | C32 | C42 | H421 | 59.8° | 60.0° |
C42 | C32 | N32 | H321 | 58.8° | 172.9° |
C42 | C32 | N32 | H322 | 175.9° | 73.3° |
C32 | C42 | C52 | H421 | 120.7° | 120.0° |
C32 | C42 | C52 | O52 | 179.3° | 180.0° |
C32 | C42 | C52 | C62 | 59.9° | 60.0° |
C32 | C42 | C52 | H521 | 60.4° | 59.9° |
H32 | C32 | N32 | H321 | 59.6° | 67.2° |
H32 | C32 | N32 | H322 | 65.6° | 46.6° |
H32 | C32 | C42 | C52 | 61.6° | 60.0° |
H32 | C32 | C42 | H421 | 178.9° | 180.0° |
C42 | C52 | O52 | C62 | 119.8° | 120.0° |
C42 | C52 | O52 | H521 | 119.9° | 120.1° |
C42 | C52 | C62 | H521 | 120.0° | 120.0° |
C42 | C52 | O52 | H52 | 179.9° | 170.7° |
C42 | C52 | C62 | O62 | 179.5° | 180.0° |
C42 | C52 | C62 | H621 | 59.4° | 60.0° |
H421 | C42 | C52 | O52 | 58.7° | 60.0° |
H421 | C42 | C52 | C62 | 60.8° | 60.0° |
H421 | C42 | C52 | H521 | 178.9° | 179.9° |
O52 | C52 | C62 | H521 | 120.3° | 120.0° |
O52 | C52 | C62 | O62 | 59.8° | 59.9° |
O52 | C52 | C62 | H621 | 60.3° | 60.0° |
C62 | C52 | O52 | H52 | 60.3° | 69.3° |
C52 | C62 | O62 | H621 | 119.8° | 120.0° |
C52 | C62 | O62 | C13 | 130.2° | 152.0° |
H521 | C52 | O52 | H52 | 60.0° | 50.7° |
H521 | C52 | C62 | O62 | 60.5° | 60.1° |
H521 | C52 | C62 | H621 | 179.4° | 180.0° |
C62 | O62 | C13 | C23 | 146.7° | 163.8° |
C62 | O62 | C13 | O53 | 93.4° | 75.9° |
C62 | O62 | C13 | H131 | 26.3° | 43.9° |
H621 | C62 | O62 | C13 | 10.3° | 32.1° |
O62 | C13 | C23 | O53 | 119.6° | 120.0° |
O62 | C13 | C23 | H131 | 120.6° | 119.9° |
O62 | C13 | O53 | H131 | 120.6° | 119.9° |
O62 | C13 | C23 | O23 | 61.5° | 61.2° |
O62 | C13 | C23 | C33 | 60.3° | 58.8° |
O62 | C13 | C23 | H231 | 179.6° | 178.6° |
O62 | C13 | O53 | C53 | 59.7° | 52.5° |
C23 | C13 | O53 | H131 | 120.4° | 120.1° |
C13 | C23 | O23 | C33 | 120.2° | 119.6° |
C13 | C23 | O23 | H231 | 120.5° | 120.3° |
C13 | C23 | C33 | H231 | 120.5° | 119.8° |
C13 | C23 | O23 | H23 | 180.0° | 60.4° |
C13 | C23 | C33 | N33 | 179.0° | 173.5° |
C13 | C23 | C33 | C43 | 58.7° | 53.6° |
C13 | C23 | C33 | H331 | 61.6° | 66.3° |
C23 | C13 | O53 | C53 | 59.4° | 67.6° |
O53 | C13 | C23 | O23 | 178.8° | 178.8° |
O53 | C13 | C23 | C33 | 59.4° | 61.2° |
O53 | C13 | C23 | H231 | 60.0° | 58.6° |
C13 | O53 | C53 | C43 | 56.1° | 67.5° |
C13 | O53 | C53 | H531 | 69.2° | 172.3° |
C13 | O53 | C53 | H532 | 178.6° | 52.5° |
H131 | C13 | C23 | O23 | 59.1° | 58.8° |
H131 | C13 | C23 | C33 | 179.1° | 178.7° |
H131 | C13 | C23 | H231 | 59.8° | 61.5° |
H131 | C13 | O53 | C53 | 179.7° | 172.3° |
O23 | C23 | C33 | H231 | 118.9° | 120.2° |
O23 | C23 | C33 | N33 | 58.4° | 66.5° |
O23 | C23 | C33 | C43 | 179.4° | 173.6° |
O23 | C23 | C33 | H331 | 59.1° | 53.7° |
C33 | C23 | O23 | H23 | 59.8° | 180.0° |
C23 | C33 | N33 | C43 | 121.6° | 119.4° |
C23 | C33 | N33 | H331 | 118.1° | 120.2° |
C23 | C33 | C43 | H331 | 118.3° | 119.8° |
C23 | C33 | N33 | C93 | 78.6° | 90.3° |
C23 | C33 | N33 | H33 | 156.1° | 156.0° |
C23 | C33 | C43 | O43 | 61.0° | 66.3° |
C23 | C33 | C43 | C83 | 180.0° | 173.4° |
C23 | C33 | C43 | C53 | 56.4° | 53.4° |
H231 | C23 | O23 | H23 | 59.6° | 59.9° |
H231 | C23 | C33 | N33 | 60.5° | 53.7° |
H231 | C23 | C33 | C43 | 61.7° | 66.2° |
H231 | C23 | C33 | H331 | 177.9° | 173.9° |
N33 | C33 | C43 | H331 | 117.6° | 120.3° |
C33 | N33 | C93 | H33 | 125.2° | 113.7° |
C33 | N33 | C93 | H931 | 180.0° | 179.9° |
C33 | N33 | C93 | H932 | 54.7° | 60.0° |
C33 | N33 | C93 | H933 | 54.7° | 60.0° |
N33 | C33 | C43 | O43 | 63.1° | 53.6° |
N33 | C33 | C43 | C83 | 55.9° | 66.7° |
N33 | C33 | C43 | C53 | 179.5° | 173.3° |
C43 | C33 | N33 | C93 | 159.8° | 150.3° |
C43 | C33 | N33 | H33 | 34.5° | 36.6° |
C33 | C43 | O43 | C83 | 122.1° | 120.4° |
C33 | C43 | O43 | C53 | 119.8° | 119.4° |
C33 | C43 | C83 | C53 | 124.0° | 119.6° |
C33 | C43 | O43 | H43 | 180.0° | 179.4° |
C33 | C43 | C83 | H831 | 180.0° | 179.6° |
C33 | C43 | C83 | H832 | 54.8° | 59.6° |
C33 | C43 | C83 | H833 | 54.7° | 60.3° |
C33 | C43 | C53 | O53 | 53.8° | 61.0° |
C33 | C43 | C53 | H531 | 71.4° | 178.8° |
C33 | C43 | C53 | H532 | 179.1° | 59.1° |
H331 | C33 | N33 | C93 | 39.5° | 29.9° |
H331 | C33 | N33 | H33 | 85.7° | 83.8° |
H331 | C33 | C43 | O43 | 179.3° | 173.9° |
H331 | C33 | C43 | C83 | 61.7° | 53.6° |
H331 | C33 | C43 | C53 | 61.9° | 66.4° |
N33 | C93 | H931 | H932 | 125.2° | 120.0° |
N33 | C93 | H931 | H933 | 125.3° | 120.0° |
N33 | C93 | H932 | H933 | 117.7° | 120.0° |
H33 | N33 | C93 | H931 | 54.8° | 66.2° |
H33 | N33 | C93 | H932 | 70.5° | 53.7° |
H33 | N33 | C93 | H933 | 179.9° | 173.8° |
H931 | C93 | H932 | H933 | 117.8° | 120.0° |
O43 | C43 | C83 | C53 | 116.2° | 120.2° |
O43 | C43 | C83 | H831 | 60.1° | 60.2° |
O43 | C43 | C83 | H832 | 174.7° | 179.8° |
O43 | C43 | C83 | H833 | 65.1° | 59.8° |
O43 | C43 | C53 | O53 | 64.8° | 58.6° |
O43 | C43 | C53 | H531 | 169.9° | 61.6° |
O43 | C43 | C53 | H532 | 60.5° | 178.7° |
C83 | C43 | O43 | H43 | 58.0° | 60.2° |
C43 | C83 | H831 | H832 | 125.3° | 120.0° |
C43 | C83 | H831 | H833 | 125.3° | 120.0° |
C43 | C83 | H832 | H833 | 117.0° | 120.0° |
C83 | C43 | C53 | O53 | 178.8° | 178.9° |
C83 | C43 | C53 | H531 | 53.5° | 58.7° |
C83 | C43 | C53 | H532 | 55.9° | 61.0° |
C53 | C43 | O43 | H43 | 60.2° | 60.0° |
C53 | C43 | C83 | H831 | 56.0° | 60.0° |
C53 | C43 | C83 | H832 | 69.2° | 60.0° |
C53 | C43 | C83 | H833 | 178.7° | 180.0° |
C43 | C53 | O53 | H531 | 125.3° | 120.2° |
C43 | C53 | O53 | H532 | 125.3° | 120.0° |
C43 | C53 | H531 | H532 | 117.8° | 119.7° |
H831 | C83 | H832 | H833 | 117.0° | 120.0° |
O53 | C53 | H531 | H532 | 117.8° | 119.8° |