0 mol 1 unq 0 iso 0 dist 9.35554 5.99543 9.00903 11.0126 7.94662 6.09918 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.40392 8.23069 5.54419 8.15652 4.33963 4.93188 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.40392 8.59466 7.36323 8.15652 4.33963 9.24958 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 6.84521 5.84171 5.73819 11.2885 5.64171 8.60739 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 8.06275 5.5249 8.80331 13.1618 9.06158 9.93832 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 8.06275 10.4413 6.20293 13.1618 9.06158 8.60739 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 8.90024 13.9129 8.80331 11.2885 9.06158 9.93832 numMergedOcc 0
7 mol 43 unq 4 iso 0 dist 8.90024 5.84171 6.20293 11.2885 9.06158 8.60739 numMergedOcc 0
8 mol 43 unq 5 iso 0 dist 6.78532 5.84171 8.93915 11.2885 11.3891 8.60739 numMergedOcc 0
9 mol 70 unq 0 iso 0 dist 6.77833 5.33532 9.65964 4.67358 9.03317 6.54023 numMergedOcc 0
10 mol 70 unq 1 iso 0 dist 9.83265 7.6455 9.65964 9.29779 9.03317 6.54023 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 9.9795 13.0232 6.19965 17.7383 7.91778 7.33422 numMergedOcc 0
12 mol 94 unq 0 iso 0 dist 6.31237 6.26149 7.89459 7.63006 5.60279 9.97569 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 7.85583 4.38646 7.71338 9.73759 8.56707 6.43433 numMergedOcc 0
14 mol 112 unq 1 iso 0 dist 8.86938 4.9102 7.71338 5.9819 8.56707 6.43433 numMergedOcc 0
15 mol 133 unq 0 iso 0 dist 9.00172 13.2145 6.29155 8.37793 5.74088 6.76699 numMergedOcc 0
16 mol 134 unq 0 iso 0 dist 5.79157 13.0109 9.86662 5.8367 5.12325 8.20836 numMergedOcc 0
17 mol 143 unq 0 iso 0 dist 7.73769 7.36837 5.99315 15.2492 12.7056 8.41611 numMergedOcc 0
18 mol 143 unq 1 iso 0 dist 7.73769 7.36837 5.99315 13.5961 12.8872 7.63338 numMergedOcc 0
19 mol 143 unq 2 iso 0 dist 7.73769 7.36837 5.99315 14.5866 7.76364 9.03707 numMergedOcc 0
20 mol 143 unq 3 iso 0 dist 7.73769 7.36837 5.99315 12.8216 9.23795 7.25673 numMergedOcc 0
21 mol 152 unq 0 iso 0 dist 8.34839 5.65129 8.56324 13.8395 9.35627 9.77552 numMergedOcc 0
22 mol 152 unq 1 iso 0 dist 8.34839 10.5295 6.70283 13.8395 9.35627 8.28642 numMergedOcc 0
23 mol 188 unq 0 iso 0 dist 8.67271 6.184 9.96154 5.36962 4.46081 8.47347 numMergedOcc 0
24 mol 209 unq 0 iso 0 dist 5.92907 5.35615 7.56373 6.43914 4.90038 8.41195 numMergedOcc 0
25 mol 214 unq 0 iso 0 dist 9.43611 11.2069 8.82096 16.5763 10.2399 8.46327 numMergedOcc 0
26 mol 222 unq 0 iso 0 dist 7.88846 6.17038 7.54212 11.1196 7.60395 8.48341 numMergedOcc 0
27 mol 229 unq 0 iso 0 dist 6.32302 6.52416 8.22528 14.0993 11.6847 8.92743 numMergedOcc 0
28 mol 229 unq 1 iso 0 dist 6.88694 6.52416 7.03423 14.0993 9.62106 8.92743 numMergedOcc 0
29 mol 229 unq 2 iso 0 dist 8.53615 6.81165 8.22528 10.3106 11.6847 8.92743 numMergedOcc 0
30 mol 236 unq 0 iso 0 dist 8.95071 12.8358 6.27581 9.33359 7.00028 8.50331 numMergedOcc 0
31 mol 248 unq 0 iso 0 dist 7.40475 7.63032 7.69895 9.08064 5.99459 6.17052 numMergedOcc 0
32 mol 248 unq 1 iso 0 dist 7.40475 6.42334 7.21521 9.08064 5.99459 9.77666 numMergedOcc 0
33 mol 252 unq 0 iso 0 dist 6.17985 6.79111 8.1148 11.5719 9.32326 6.11473 numMergedOcc 0
34 mol 252 unq 1 iso 0 dist 6.17985 6.79111 8.1148 8.62351 5.89666 8.47784 numMergedOcc 0
35 mol 252 unq 2 iso 0 dist 6.17985 6.79111 8.1148 11.7534 11.056 6.53679 numMergedOcc 0
36 mol 252 unq 3 iso 0 dist 6.17985 6.02958 8.33025 11.7534 11.056 7.50201 numMergedOcc 0
37 mol 258 unq 0 iso 0 dist 9.2067 9.88911 6.42289 8.43941 5.27959 9.53063 numMergedOcc 0
38 mol 261 unq 0 iso 0 dist 9.80409 4.63237 9.14619 5.67349 6.04016 5.26434 numMergedOcc 0
39 mol 261 unq 1 iso 0 dist 9.80409 6.39263 8.45658 5.67349 6.04016 8.60026 numMergedOcc 0
