0 mol 58 unq 0 iso 0 dist 8.68096 8.96181 7.84103 6.82279 9.92438 12.8726 numMergedOcc 0
1 mol 58 unq 1 iso 0 dist 8.68096 8.96181 7.84103 5.52874 7.66055 7.4785 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 8.45469 5.23167 3.66673 10.035 9.27092 9.81276 numMergedOcc 0
3 mol 62 unq 1 iso 0 dist 5.48766 6.0827 8.07308 4.94224 6.56664 10.7886 numMergedOcc 0
4 mol 62 unq 2 iso 0 dist 5.48766 6.0827 8.07308 11.7123 9.58156 15.3189 numMergedOcc 0
5 mol 62 unq 3 iso 0 dist 9.63139 6.0827 10.3525 4.94224 9.96382 10.7886 numMergedOcc 0
6 mol 62 unq 4 iso 0 dist 9.63139 6.0827 10.3525 11.7123 7.59416 15.3189 numMergedOcc 0
7 mol 65 unq 0 iso 0 dist 7.72373 9.42411 9.15718 10.8737 9.75927 17.3766 numMergedOcc 0
8 mol 71 unq 0 iso 0 dist 7.56624 6.5009 6.01777 14.9361 9.95096 15.9159 numMergedOcc 0
9 mol 113 unq 0 iso 0 dist 8.44588 9.27028 3.7042 4.83846 8.29529 7.02367 numMergedOcc 0
10 mol 117 unq 0 iso 0 dist 6.98104 5.56913 8.97988 13.0727 9.60425 17.5035 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 8.99783 6.84006 5.90666 9.19433 9.96969 12.8123 numMergedOcc 0
12 mol 120 unq 1 iso 0 dist 7.30776 9.08322 5.90666 6.08069 9.96969 12.8123 numMergedOcc 0
13 mol 120 unq 2 iso 0 dist 8.82602 8.02114 5.90666 10.121 9.96969 12.8123 numMergedOcc 0
14 mol 152 unq 0 iso 0 dist 9.44435 9.3776 5.0146 12.8882 9.37459 7.59457 numMergedOcc 0
15 mol 152 unq 1 iso 0 dist 9.44435 9.3776 5.0146 16.0649 9.0847 9.00072 numMergedOcc 0
16 mol 152 unq 2 iso 0 dist 9.44435 9.3776 5.0146 10.6678 6.00061 7.55419 numMergedOcc 0
17 mol 152 unq 3 iso 0 dist 9.44435 9.3776 5.0146 12.9783 8.33302 12.1307 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 9.41577 8.402 5.6022 7.79624 7.40081 10.9518 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 6.14231 8.26228 7.71002 6.9758 9.00498 13.5846 numMergedOcc 0
20 mol 281 unq 0 iso 0 dist 9.79394 8.78416 3.86368 6.83107 7.04661 5.50053 numMergedOcc 0
21 mol 281 unq 1 iso 0 dist 9.79394 9.22428 7.4282 6.83107 7.04661 7.33334 numMergedOcc 0
22 mol 281 unq 2 iso 0 dist 6.52115 7.82358 3.86368 5.22248 7.04661 5.50053 numMergedOcc 0
