You can not select more than 25 topics
Topics must start with a letter or number, can include dashes ('-') and can be up to 35 characters long.
22 lines
861 B
22 lines
861 B
2 years ago
|
5
|
||
|
|
Coordinates from ORCA-job cmmd E -4.174962272510
|
||
|
|
C 1.068140 0.069870 0.021800
|
||
|
|
H 2.160340 0.069870 0.021800
|
||
|
|
H 0.704080 -0.652790 0.755360
|
||
|
|
H 0.704070 -0.204080 -0.970830
|
||
|
|
H 0.704070 1.066480 0.280860
|
||
|
|
5
|
||
|
|
Coordinates from ORCA-job cmmd E -4.175218465760
|
||
|
|
C 1.068140 0.069870 0.021798
|
||
|
|
H 2.150450 0.069870 0.021798
|
||
|
|
H 0.707375 -0.646250 0.748718
|
||
|
|
H 0.707369 -0.201600 -0.961839
|
||
|
|
H 0.707366 1.057460 0.278514
|
||
|
|
5
|
||
|
|
Coordinates from ORCA-job cmmd E -4.175218519970
|
||
|
|
C 1.068140 0.069870 0.021798
|
||
|
|
H 2.150300 0.069871 0.021797
|
||
|
|
H 0.707424 -0.646152 0.748618
|
||
|
|
H 0.707419 -0.201563 -0.961703
|
||
|
|
H 0.707417 1.057324 0.278480
|