0 mol 9 unq 0 iso 0 dist 6.3716 6.06761 6.20227 14.995 10.6533 9.78006 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 9.78224 6.39663 5.11883 10.8304 4.9399 8.72023 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 7.57379 8.0278 5.11883 11.749 4.9399 8.72023 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 9.43824 7.71584 5.44124 10.0461 5.52519 5.81959 numMergedOcc 0
4 mol 25 unq 1 iso 0 dist 9.43824 7.71584 5.44124 12.9845 7.19007 6.90155 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.47208 4.73318 9.22853 10.1845 8.00278 7.04044 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.47208 4.73318 9.22853 10.8928 10.4159 8.73253 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 7.54915 13.3069 6.00564 12.3148 6.62562 8.00777 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 7.54915 13.3069 6.00564 10.7029 5.46695 7.1589 numMergedOcc 0
9 mol 109 unq 0 iso 0 dist 9.08102 5.70461 7.04752 6.31633 9.44195 8.67766 numMergedOcc 0
10 mol 109 unq 1 iso 0 dist 9.08102 5.70461 7.04752 7.21115 4.26194 8.0831 numMergedOcc 0
11 mol 111 unq 0 iso 0 dist 7.22098 7.13575 6.98727 8.42147 6.3561 7.71107 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 6.58995 5.37121 4.31261 10.4218 4.72999 6.98934 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 6.58995 7.65435 7.7186 10.4218 4.72999 7.99623 numMergedOcc 0
14 mol 120 unq 0 iso 0 dist 9.35573 9.0525 9.23243 16.7481 12.4334 8.93905 numMergedOcc 0
15 mol 148 unq 0 iso 0 dist 8.78761 6.41267 6.49708 12.2042 5.29844 9.02318 numMergedOcc 0
16 mol 148 unq 1 iso 0 dist 8.78761 6.41267 6.49708 14.5372 6.55924 9.74542 numMergedOcc 0
17 mol 148 unq 2 iso 0 dist 8.78761 6.41267 6.49708 13.5063 9.61708 7.97543 numMergedOcc 0
18 mol 148 unq 3 iso 0 dist 5.69707 8.58803 6.49708 9.64457 5.29844 9.02318 numMergedOcc 0
19 mol 148 unq 4 iso 0 dist 5.69707 8.58803 6.49708 12.1607 6.55924 9.74542 numMergedOcc 0
20 mol 148 unq 5 iso 0 dist 5.69707 8.58803 6.49708 14.0403 9.61708 7.97543 numMergedOcc 0
21 mol 150 unq 0 iso 0 dist 8.75537 6.48054 6.45018 14.5362 6.62435 9.6606 numMergedOcc 0
22 mol 150 unq 1 iso 0 dist 8.75537 6.48054 6.45018 13.5458 9.72618 7.85526 numMergedOcc 0
23 mol 150 unq 2 iso 0 dist 8.75537 6.48054 6.45018 12.2868 5.50847 8.94552 numMergedOcc 0
24 mol 150 unq 3 iso 0 dist 5.62239 8.52718 6.45018 12.148 6.62435 9.6606 numMergedOcc 0
25 mol 150 unq 4 iso 0 dist 5.62239 8.52718 6.45018 14.0778 9.72618 7.85526 numMergedOcc 0
26 mol 150 unq 5 iso 0 dist 5.62239 8.52718 6.45018 9.80731 5.50847 8.94552 numMergedOcc 0
27 mol 214 unq 0 iso 0 dist 5.10016 5.20422 7.48626 8.49704 10.2428 6.38157 numMergedOcc 0
28 mol 218 unq 0 iso 0 dist 9.27398 10.8446 6.45821 15.8381 7.79008 8.0751 numMergedOcc 0
29 mol 230 unq 0 iso 0 dist 9.48167 9.7405 7.74885 17.676 15.5042 9.09271 numMergedOcc 0
30 mol 230 unq 1 iso 0 dist 9.48167 9.7405 7.74885 15.5954 11.3478 7.44838 numMergedOcc 0
31 mol 230 unq 2 iso 0 dist 9.2573 9.97168 7.74885 18.8843 15.5042 9.09271 numMergedOcc 0
32 mol 230 unq 3 iso 0 dist 9.2573 9.97168 7.74885 17.1088 11.3478 7.44838 numMergedOcc 0
33 mol 251 unq 0 iso 0 dist 8.63134 4.20853 6.12282 12.2132 7.703 8.01198 numMergedOcc 0
34 mol 285 unq 0 iso 0 dist 8.45077 6.93502 5.04032 8.71213 6.40962 5.31728 numMergedOcc 0
