0 mol 12 unq 0 iso 0 dist 7.4036 7.00079 5.76024 10.5078 9.90835 5.21529 numMergedOcc 0
1 mol 12 unq 1 iso 0 dist 7.4036 6.50215 7.92714 10.5078 9.90835 9.7731 numMergedOcc 0
2 mol 12 unq 2 iso 0 dist 7.4036 12.5814 8.47217 10.5078 9.90835 5.41989 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 7.89222 10.7484 6.93197 6.29981 6.07276 10.1622 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 9.53735 12.3478 7.35861 8.87921 9.36924 6.88067 numMergedOcc 0
5 mol 26 unq 2 iso 0 dist 9.34599 13.7277 7.35861 17.7357 9.36924 6.88067 numMergedOcc 0
6 mol 26 unq 3 iso 0 dist 6.32127 8.08257 6.56527 4.56199 6.7142 10.0347 numMergedOcc 0
7 mol 46 unq 0 iso 0 dist 8.5377 4.03395 8.0543 8.32637 5.96231 10.324 numMergedOcc 0
8 mol 68 unq 0 iso 0 dist 7.3797 5.42651 6.74766 12.0803 7.98985 12.5617 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 8.7389 5.29835 8.95905 7.7447 7.46095 6.6642 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 6.73172 12.4858 7.80873 7.35282 8.72725 8.72143 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 6.73172 12.4858 7.80873 8.43423 6.11407 5.08111 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 5.80081 11.3904 9.83945 7.09621 7.42144 16.2294 numMergedOcc 0
13 mol 141 unq 1 iso 0 dist 5.80081 11.3904 9.83945 7.46533 6.27658 15.9806 numMergedOcc 0
14 mol 141 unq 2 iso 0 dist 9.45931 7.98447 6.75376 11.3431 9.27009 6.93828 numMergedOcc 0
15 mol 141 unq 3 iso 0 dist 6.49728 11.3904 6.75376 14.123 9.27009 6.93828 numMergedOcc 0
16 mol 141 unq 4 iso 0 dist 6.35397 7.98447 9.10042 12.017 6.65731 14.0725 numMergedOcc 0
17 mol 141 unq 5 iso 0 dist 6.35397 8.12085 9.75059 12.017 6.65731 13.1981 numMergedOcc 0
18 mol 141 unq 6 iso 0 dist 6.35397 10.1812 6.83404 12.017 6.65731 3.98068 numMergedOcc 0
19 mol 184 unq 0 iso 0 dist 5.11863 6.2568 7.54099 7.85099 7.58375 4.67256 numMergedOcc 0
20 mol 184 unq 1 iso 0 dist 5.92785 9.41221 7.54099 6.97246 7.58375 4.67256 numMergedOcc 0
21 mol 192 unq 0 iso 0 dist 7.27051 13.0844 8.26288 5.45761 9.40971 11.3394 numMergedOcc 0
22 mol 192 unq 1 iso 0 dist 7.27051 5.76622 6.60053 5.45761 9.40971 5.80651 numMergedOcc 0
23 mol 192 unq 2 iso 0 dist 7.35424 5.76622 9.36796 5.45761 9.8428 5.80651 numMergedOcc 0
24 mol 196 unq 0 iso 0 dist 5.21339 10.6902 9.62455 10.7178 8.48879 5.40367 numMergedOcc 0
25 mol 196 unq 1 iso 0 dist 5.21339 10.6902 9.62455 9.37254 5.89591 11.2785 numMergedOcc 0
26 mol 196 unq 2 iso 0 dist 5.21339 10.6902 9.62455 12.899 9.72376 17.7382 numMergedOcc 0
27 mol 196 unq 3 iso 0 dist 6.34867 13.7873 9.62455 10.3148 8.48879 5.40367 numMergedOcc 0
28 mol 196 unq 4 iso 0 dist 6.34867 13.7873 9.62455 4.06845 5.89591 11.2785 numMergedOcc 0
29 mol 196 unq 5 iso 0 dist 6.34867 13.7873 9.62455 5.57156 9.72376 17.7382 numMergedOcc 0
30 mol 256 unq 0 iso 0 dist 8.95444 9.21273 6.33496 5.62448 6.85663 8.60707 numMergedOcc 0
31 mol 256 unq 1 iso 0 dist 8.95444 7.94816 6.00636 5.62448 6.85663 9.39697 numMergedOcc 0
32 mol 256 unq 2 iso 0 dist 8.95444 9.60388 7.81448 5.62448 6.85663 4.05082 numMergedOcc 0
33 mol 256 unq 3 iso 0 dist 8.95444 10.878 8.54499 5.62448 6.85663 6.63324 numMergedOcc 0
34 mol 256 unq 4 iso 0 dist 7.53508 11.5159 6.33496 6.54518 6.85663 8.60707 numMergedOcc 0
35 mol 256 unq 5 iso 0 dist 7.53508 12.9357 6.00636 6.54518 6.85663 9.39697 numMergedOcc 0
36 mol 256 unq 6 iso 0 dist 7.53508 4.03381 7.81448 6.54518 6.85663 4.05082 numMergedOcc 0
37 mol 256 unq 7 iso 0 dist 7.53508 7.45598 8.54499 6.54518 6.85663 6.63324 numMergedOcc 0
