0 mol 1 unq 0 iso 0 dist 9.76602 13.2564 8.54503 9.84669 7.83632 4.17249 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 9.25493 8.18351 9.52857 10.3414 6.96422 14.8356 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 6.23138 4.69203 5.94373 6.84612 9.32552 4.97497 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 8.27794 15.6662 8.55826 8.32999 9.83981 18.0914 numMergedOcc 0
4 mol 114 unq 1 iso 0 dist 8.27794 15.6662 8.55826 5.28095 6.13559 13.7458 numMergedOcc 0
5 mol 114 unq 2 iso 0 dist 8.27794 15.6662 8.55826 11.5542 6.51395 8.67095 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 6.03154 7.5191 8.73383 8.80709 6.98158 5.53962 numMergedOcc 0
7 mol 168 unq 0 iso 0 dist 8.90876 4.65845 5.24076 6.39941 7.60254 7.08042 numMergedOcc 0
8 mol 173 unq 0 iso 0 dist 9.51638 5.64974 8.14167 12.905 6.64779 13.5257 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 6.95568 3.97959 8.90567 6.28043 6.32777 4.98086 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 9.07527 12.93 9.2933 6.24616 5.97685 14.0045 numMergedOcc 0
11 mol 181 unq 2 iso 0 dist 9.07527 12.93 9.2933 12.5567 8.9289 17.8726 numMergedOcc 0
12 mol 241 unq 0 iso 0 dist 9.28598 5.85623 5.6297 10.8036 8.00537 6.83816 numMergedOcc 0
13 mol 243 unq 0 iso 0 dist 8.55613 6.42012 9.18477 10.4928 7.12785 12.2233 numMergedOcc 0
14 mol 243 unq 1 iso 0 dist 8.55613 6.42012 9.18477 4.20431 6.66959 4.54892 numMergedOcc 0
15 mol 273 unq 0 iso 0 dist 6.38341 3.92089 9.16554 9.11005 8.68913 8.67797 numMergedOcc 0
16 mol 273 unq 1 iso 0 dist 6.38341 9.51983 9.65597 9.11005 8.68913 17.2732 numMergedOcc 0
17 mol 273 unq 2 iso 0 dist 9.78826 3.92089 8.83491 13.7838 8.85779 13.2599 numMergedOcc 0
18 mol 273 unq 3 iso 0 dist 9.78826 12.0094 9.02711 13.7838 8.85779 10.9195 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.60049 10.3798 9.5144 7.69175 5.7131 13.074 numMergedOcc 0
