0 mol 1 unq 0 iso 0 dist 9.19543 7.68779 6.13271 7.16224 7.64327 10.2665 5.96722 11.399 6.4181 11.5824 numMergedOcc 0
1 mol 33 unq 0 iso 0 dist 5.65377 7.15141 6.08005 6.53932 5.31968 10.0784 11.0298 11.1496 7.14232 12.4758 numMergedOcc 0
2 mol 33 unq 1 iso 0 dist 5.65377 7.15141 6.08005 11.3882 9.86405 14.7934 11.0298 11.1496 7.14232 16.0628 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 9.32172 7.80757 9.0996 8.73 9.43893 9.99029 10.928 12.3746 9.23023 5.00649 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 9.32172 5.5849 6.50212 8.73 9.43893 11.477 10.1482 15.357 9.10981 18.757 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 8.93486 8.75605 6.50212 6.56035 9.43893 11.477 14.1713 15.357 9.10981 18.757 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 9.23907 7.28711 5.27581 14.1047 8.01351 12.2123 12.1555 9.89813 9.3931 17.5868 numMergedOcc 0
7 mol 91 unq 1 iso 0 dist 9.23907 7.28711 5.27581 7.54043 8.98201 8.30169 12.1555 9.89813 9.3931 5.4965 numMergedOcc 0
8 mol 91 unq 2 iso 0 dist 9.23907 7.28711 5.27581 8.05785 6.4026 8.91983 12.1555 9.89813 9.3931 8.87123 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 7.62006 4.93984 7.01116 4.72853 7.04009 8.58946 6.87303 13.7816 8.14096 11.1988 numMergedOcc 0
10 mol 167 unq 1 iso 0 dist 7.62006 4.93984 7.01116 4.72853 7.04009 8.58946 6.01114 9.38623 8.43038 5.44954 numMergedOcc 0
11 mol 167 unq 2 iso 0 dist 7.62006 4.93984 7.01116 4.72853 7.04009 8.58946 9.04662 11.5246 9.87966 9.15105 numMergedOcc 0
12 mol 192 unq 0 iso 0 dist 9.44978 9.05666 4.94984 8.94989 9.37214 11.1541 11.524 13.6095 9.90531 12.6678 numMergedOcc 0
13 mol 218 unq 0 iso 0 dist 6.43416 5.52981 6.75711 6.43128 5.51354 9.88212 7.26513 7.38022 8.5119 5.55907 numMergedOcc 0
14 mol 249 unq 0 iso 0 dist 7.10933 6.42827 8.71871 8.73111 9.19506 14.5656 7.26569 10.7935 6.37672 13.5354 numMergedOcc 0
15 mol 249 unq 1 iso 0 dist 7.10933 6.42827 8.71871 8.73111 9.19506 14.5656 6.09915 11.0038 8.94023 10.542 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 5.90175 4.96568 4.75685 11.7587 8.43749 7.54805 9.37522 8.09021 9.772 9.91968 numMergedOcc 0
17 mol 279 unq 0 iso 0 dist 7.07268 8.27977 4.51764 4.91933 7.69328 10.8434 4.0145 8.53542 7.74162 8.91353 numMergedOcc 0
18 mol 279 unq 1 iso 0 dist 7.07268 8.27977 4.51764 8.89193 8.93979 5.17586 4.0145 8.53542 7.74162 6.05412 numMergedOcc 0
