0 mol 32 unq 0 iso 0 dist 6.35945 4.14768 4.62858 10.12 6.68431 7.99969 6.53804 8.74576 6.30042 7.26268 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 8.91572 9.49599 6.04903 17.0398 11.7069 7.56205 8.91835 9.1062 4.09232 9.69044 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 8.91572 9.49599 6.04903 11.295 5.49555 4.74544 8.91835 9.1062 4.09232 6.9103 numMergedOcc 0
3 mol 98 unq 0 iso 0 dist 7.00373 7.65932 6.0129 12.9741 8.70415 6.7117 10.9661 6.61111 3.94967 5.10496 numMergedOcc 0
4 mol 98 unq 1 iso 0 dist 7.00373 7.65932 6.0129 11.233 10.0962 4.47349 4.54306 4.44979 3.92737 7.54889 numMergedOcc 0
5 mol 98 unq 2 iso 0 dist 7.00373 7.65932 6.0129 11.233 10.0962 4.47349 10.9661 6.61111 3.94967 5.2571 numMergedOcc 0
6 mol 98 unq 3 iso 0 dist 7.00373 7.65932 6.0129 9.48388 11.2452 5.65185 4.54306 4.44979 3.92737 7.78931 numMergedOcc 0
7 mol 98 unq 4 iso 0 dist 7.00373 7.65932 6.0129 9.48388 11.2452 5.65185 10.9661 6.61111 3.94967 8.7497 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 8.72056 11.4949 8.55616 12.199 5.3585 6.23142 4.78701 7.43401 6.93712 9.33094 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 8.72056 11.4949 8.55616 9.11672 6.74887 9.94764 3.64555 6.44575 11.5269 9.1998 numMergedOcc 0
10 mol 134 unq 2 iso 0 dist 8.72056 11.4949 8.55616 9.11672 6.74887 9.94764 4.78701 7.43401 6.93712 8.69531 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 9.92106 6.3866 6.97487 11.9411 10.0989 7.78652 18.0101 13.3985 12.207 7.36975 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 9.92106 6.3866 6.97487 11.9411 10.0989 7.78652 12.9512 14.6265 10.0079 5.40637 numMergedOcc 0
13 mol 159 unq 0 iso 0 dist 9.35522 7.09754 6.72852 12.2134 6.49376 9.17787 11.771 12.0832 7.91903 9.36259 numMergedOcc 0
14 mol 159 unq 1 iso 0 dist 9.35522 14.4645 8.52082 12.2134 6.49376 8.4858 11.771 12.0832 9.65034 9.36259 numMergedOcc 0
15 mol 159 unq 2 iso 0 dist 7.3956 8.08649 6.72852 12.6331 6.49376 9.17787 14.9 12.0832 7.91903 9.36259 numMergedOcc 0
16 mol 159 unq 3 iso 0 dist 7.3956 14.173 8.52082 12.6331 6.49376 8.4858 14.9 12.0832 9.65034 9.36259 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 9.19369 13.5186 8.71497 11.1914 11.6195 7.98231 15.7491 9.43105 4.10176 9.46361 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 9.19369 13.5186 8.71497 9.89728 5.79468 7.08526 13.7396 6.23661 4.47425 5.85442 numMergedOcc 0
19 mol 259 unq 2 iso 0 dist 9.19369 13.5186 8.71497 9.89728 5.79468 7.08526 15.7491 9.43105 4.10176 6.95511 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 9.99897 5.63261 5.59555 14.6115 7.23534 9.65934 9.36666 8.59762 5.97664 7.45616 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 9.99897 5.63261 5.59555 14.6115 7.23534 9.65934 9.36666 8.59762 5.97664 7.45616 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 9.99897 5.63261 5.59555 14.6115 7.23534 9.65934 9.36666 8.59762 5.97664 7.45616 numMergedOcc 0
