0 mol 12 unq 0 iso 0 dist 9.1301 9.11059 9.52857 9.56849 6.96422 14.8356 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 8.01372 6.32851 6.6691 4.4802 4.76018 7.03296 numMergedOcc 0
2 mol 12 unq 2 iso 0 dist 9.57429 6.52451 9.7652 4.4802 7.13046 8.98903 numMergedOcc 0
3 mol 12 unq 3 iso 0 dist 9.57429 6.32851 9.23807 4.4802 7.13046 7.03296 numMergedOcc 0
4 mol 15 unq 0 iso 0 dist 5.94245 9.36663 8.3794 5.85257 6.50647 4.96682 numMergedOcc 0
5 mol 130 unq 0 iso 0 dist 5.65876 12.7823 7.7461 11.3038 6.90634 8.88349 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 6.93424 4.75097 8.81111 13.2439 7.31037 15.0866 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 8.94488 4.0331 6.69487 5.63253 9.6096 6.66039 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 6.07708 6.2739 8.14167 9.00192 6.64779 13.5257 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 8.83185 6.2128 7.08557 12.188 7.05653 10.2555 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 9.0234 13.88 7.08557 4.56814 7.05653 10.2555 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 6.62283 12.7339 9.49129 9.28896 8.90076 5.05275 numMergedOcc 0
12 mol 238 unq 1 iso 0 dist 6.62283 12.7339 9.49129 4.40826 6.87131 15.0682 numMergedOcc 0
13 mol 238 unq 2 iso 0 dist 6.62283 12.7339 9.49129 6.04481 8.09718 13.1727 numMergedOcc 0
14 mol 238 unq 3 iso 0 dist 8.60978 12.7339 6.80544 9.28896 6.62002 5.05275 numMergedOcc 0
15 mol 238 unq 4 iso 0 dist 8.60978 12.7339 6.80544 4.40826 9.69818 15.0682 numMergedOcc 0
16 mol 238 unq 5 iso 0 dist 8.60978 12.7339 6.80544 6.04481 6.73446 13.1727 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.499 4.72952 5.95622 6.19462 5.88802 4.81796 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 9.36895 7.46206 5.6297 8.28913 8.00537 6.83816 numMergedOcc 0
