0 mol 143 unq 0 iso 0 dist 8.20024 8.72463 4.98373 12.8171 10.8896 7.5984 14.0766 9.73212 5.99315 5.11989 numMergedOcc 0
1 mol 143 unq 1 iso 0 dist 7.19059 8.72463 10.6381 12.8171 10.5322 7.5984 14.0766 13.7165 5.99315 5.11989 numMergedOcc 0
2 mol 175 unq 0 iso 0 dist 7.01007 7.04318 6.15969 8.21784 8.6609 6.73365 8.09861 10.7272 5.6234 5.73338 numMergedOcc 0
3 mol 175 unq 1 iso 0 dist 7.01007 7.04318 6.15969 8.21784 8.6609 6.73365 10.1323 14.7648 9.92231 12.753 numMergedOcc 0
4 mol 210 unq 0 iso 0 dist 8.87835 7.19917 5.82028 7.45619 6.24111 8.07523 9.55205 9.67457 6.18308 13.3929 numMergedOcc 0
5 mol 210 unq 1 iso 0 dist 8.87835 7.19917 5.82028 4.70332 9.00343 7.56882 9.55205 9.67457 6.18308 12.3088 numMergedOcc 0
6 mol 210 unq 2 iso 0 dist 8.93859 7.19917 4.62641 7.45619 8.60412 8.07523 9.55205 9.90494 6.18308 13.3929 numMergedOcc 0
7 mol 210 unq 3 iso 0 dist 8.93859 7.19917 4.62641 4.70332 7.05535 7.56882 9.55205 9.90494 6.18308 12.3088 numMergedOcc 0
8 mol 224 unq 0 iso 0 dist 7.73616 7.69537 7.85135 9.41461 9.08719 7.04127 5.92906 13.1222 9.40098 11.7724 numMergedOcc 0
9 mol 224 unq 1 iso 0 dist 7.73616 7.69537 7.85135 9.41461 9.08719 7.04127 5.41675 6.08709 6.61986 4.55824 numMergedOcc 0
10 mol 231 unq 0 iso 0 dist 9.16488 8.17766 5.3251 6.17101 7.28719 9.98232 11.3675 7.79865 7.37839 10.9863 numMergedOcc 0
11 mol 231 unq 1 iso 0 dist 9.16488 8.17766 5.3251 6.17101 7.28719 9.98232 12.5238 6.14348 8.40182 10.2117 numMergedOcc 0
12 mol 231 unq 2 iso 0 dist 9.35875 9.84965 9.0084 14.1831 17.4947 9.98232 14.0116 15.5078 7.37839 10.9863 numMergedOcc 0
13 mol 231 unq 3 iso 0 dist 9.35875 9.84965 9.0084 14.1831 17.4947 9.98232 16.7305 17.1148 8.40182 10.2117 numMergedOcc 0
14 mol 241 unq 0 iso 0 dist 8.99792 8.62971 4.86437 7.14491 9.174 6.40592 4.99503 9.72526 7.4631 7.93809 numMergedOcc 0
15 mol 261 unq 0 iso 0 dist 8.9569 7.7309 15.7709 11.0146 17.5069 9.43169 9.29412 17.9341 6.05727 6.5875 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 9.97669 4.96568 5.11366 11.7587 4.03921 7.54805 5.25115 12.3211 8.4218 12.5953 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 8.85653 8.27977 6.03718 8.89193 8.57035 5.17586 13.1217 14.3672 9.70696 5.9229 numMergedOcc 0
18 mol 282 unq 0 iso 0 dist 9.40138 7.70229 4.58403 5.64349 7.93511 6.84554 8.93697 5.67266 8.76532 9.67023 numMergedOcc 0
19 mol 282 unq 1 iso 0 dist 9.40138 7.90792 5.04235 5.64349 7.93511 9.51581 8.93697 5.67266 6.33524 9.67023 numMergedOcc 0
20 mol 282 unq 2 iso 0 dist 8.37963 7.70229 14.9812 5.64349 12.1147 6.84554 8.93697 16.9709 8.76532 9.67023 numMergedOcc 0
21 mol 282 unq 3 iso 0 dist 8.37963 7.90792 15.4482 5.64349 12.1147 9.51581 8.93697 16.9709 6.33524 9.67023 numMergedOcc 0
