0 mol 14 unq 0 iso 0 dist 6.11408 9.22226 5.0301 8.54362 8.66151 8.9616 numMergedOcc 0
1 mol 36 unq 0 iso 0 dist 4.10339 7.11464 6.94144 6.6055 6.03866 3.58776 numMergedOcc 0
2 mol 37 unq 0 iso 0 dist 8.40835 9.92538 11.4772 9.7385 12.0019 4.58146 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 7.30392 5.44722 12.2954 6.42645 13.0684 5.85606 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 7.14979 7.35929 4.49645 6.0662 7.8595 5.28622 numMergedOcc 0
5 mol 103 unq 0 iso 0 dist 5.72494 9.61913 6.12629 7.85115 11.4876 16.6049 numMergedOcc 0
6 mol 103 unq 1 iso 0 dist 8.70106 9.61913 12.2951 7.85115 11.2795 16.6049 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 8.60157 9.92375 13.7802 7.91749 3.54257 11.5773 numMergedOcc 0
8 mol 148 unq 1 iso 0 dist 6.72591 9.92375 9.82423 7.91749 8.03052 11.5773 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 6.45502 9.58371 5.97811 4.80508 7.82494 11.8112 numMergedOcc 0
10 mol 158 unq 1 iso 0 dist 6.45502 9.58371 5.97811 4.88625 5.34159 10.454 numMergedOcc 0
11 mol 165 unq 0 iso 0 dist 3.87901 8.67001 7.1886 6.74196 4.89071 10.7696 numMergedOcc 0
12 mol 167 unq 0 iso 0 dist 6.6514 7.93807 7.33075 8.87575 11.6251 14.2454 numMergedOcc 0
13 mol 168 unq 0 iso 0 dist 9.88342 9.63679 5.58658 6.24232 9.69599 7.27069 numMergedOcc 0
14 mol 168 unq 1 iso 0 dist 9.88342 9.63679 5.58658 6.13116 7.91845 4.51252 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 9.39563 5.11863 8.78943 9.15923 4.75805 6.04545 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 9.39563 5.11863 8.78943 7.79098 11.6574 4.12242 numMergedOcc 0
17 mol 184 unq 2 iso 0 dist 7.51045 5.92785 8.78943 6.03505 4.75805 6.04545 numMergedOcc 0
18 mol 184 unq 3 iso 0 dist 7.51045 5.92785 8.78943 6.30144 11.6574 4.12242 numMergedOcc 0
19 mol 192 unq 0 iso 0 dist 9.67207 7.27051 13.2917 8.42665 9.82858 6.73951 numMergedOcc 0
20 mol 192 unq 1 iso 0 dist 9.67207 7.35424 10.3343 8.42665 9.82858 6.53644 numMergedOcc 0
21 mol 214 unq 0 iso 0 dist 5.12798 8.95218 5.30923 9.22105 6.23176 10.6198 numMergedOcc 0
22 mol 247 unq 0 iso 0 dist 6.56182 6.76933 12.7218 5.27761 6.27547 8.67313 numMergedOcc 0
23 mol 247 unq 1 iso 0 dist 5.32075 6.76933 5.44215 5.27761 7.88685 8.67313 numMergedOcc 0
24 mol 254 unq 0 iso 0 dist 9.73281 9.00866 8.60531 8.4346 11.7618 4.4384 numMergedOcc 0
25 mol 254 unq 1 iso 0 dist 9.73281 9.00866 8.60531 7.97728 11.7378 6.09569 numMergedOcc 0
26 mol 276 unq 0 iso 0 dist 8.0652 8.74282 7.57645 9.97709 16.9357 13.3582 numMergedOcc 0
27 mol 284 unq 0 iso 0 dist 5.62295 5.61727 6.50962 4.69611 8.4652 3.57807 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 4.66252 9.52718 13.0167 8.08382 12.1302 5.39801 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 4.66252 9.52718 13.0167 8.08382 12.1302 5.39801 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 4.66252 9.52718 13.0167 8.08382 12.1302 5.39801 numMergedOcc 0
