0 mol 70 unq 0 iso 0 dist 9.74268 14.243 7.63663 10.7301 7.92394 14.4842 7.95122 5.22626 12.2091 8.33704 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 8.28737 13.6156 5.56964 12.2209 8.19682 7.5192 15.3483 10.2879 8.41567 6.21982 numMergedOcc 0
2 mol 117 unq 0 iso 0 dist 9.41387 5.53825 7.0318 6.69306 6.62561 5.70073 13.8525 7.22206 11.0698 7.63616 numMergedOcc 0
3 mol 134 unq 0 iso 0 dist 6.99089 9.32667 5.57904 15.1358 8.6355 7.26771 15.1189 8.80819 12.3933 8.79571 numMergedOcc 0
4 mol 134 unq 1 iso 0 dist 6.99089 9.32667 5.57904 15.1358 8.6355 7.26771 11.6481 5.00817 7.27598 5.42582 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 4.93035 5.38959 7.34465 6.70767 6.93652 11.9359 10.4824 5.67306 12.54 9.54444 numMergedOcc 0
6 mol 156 unq 0 iso 0 dist 7.80643 11.1371 9.19499 5.58352 9.36805 11.9162 7.39961 5.76755 14.1844 8.47155 numMergedOcc 0
7 mol 156 unq 1 iso 0 dist 7.80643 11.1371 9.19499 5.58352 9.36805 11.9162 10.8849 8.38403 13.581 7.55203 numMergedOcc 0
8 mol 218 unq 0 iso 0 dist 6.22077 4.44409 8.2088 6.48676 7.13323 7.85937 5.52981 7.83217 9.82905 7.17547 numMergedOcc 0
9 mol 238 unq 0 iso 0 dist 7.2527 11.2481 5.67917 14.0776 9.90142 10.761 10.3304 5.40359 8.96639 5.9216 numMergedOcc 0
10 mol 238 unq 1 iso 0 dist 9.29203 14.3786 5.67917 11.091 9.90142 10.761 7.62771 5.40359 8.96639 5.9216 numMergedOcc 0
11 mol 238 unq 2 iso 0 dist 7.62771 14.3786 8.96639 12.4266 9.68513 12.8735 7.80166 10.1648 12.6253 9.29858 numMergedOcc 0
12 mol 238 unq 3 iso 0 dist 7.62771 14.3786 8.96639 11.091 5.9216 10.761 9.29203 5.40359 5.67917 9.90142 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 6.93507 5.35689 7.72708 5.63238 8.96876 6.94174 6.42827 8.34718 11.455 8.83735 numMergedOcc 0
14 mol 272 unq 0 iso 0 dist 7.66615 13.1178 7.31993 6.68919 9.09992 13.7563 7.22438 5.40809 12.3168 6.73206 numMergedOcc 0
