0 mol 8 unq 0 iso 0 dist 7.58816 4.97265 5.41248 8.79328 4.92734 7.36147 14.7448 7.35767 12.5407 8.96553 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.58816 4.97265 5.41248 8.5845 6.57999 10.1093 14.7448 7.35767 12.5407 9.62879 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.34361 14.1632 6.29755 13.2619 6.54183 5.58127 5.97635 5.65405 9.89662 8.10861 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 8.34361 15.4599 7.4038 13.2619 6.54183 5.54544 5.97635 5.65405 11.7963 8.10861 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 9.91313 12.5852 7.77128 7.49081 9.70415 16.1373 10.5781 5.46309 12.841 6.65721 numMergedOcc 0
5 mol 61 unq 1 iso 0 dist 9.91313 12.5852 7.77128 7.49081 9.70415 16.1373 12.4244 11.9897 18.5951 6.72123 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 5.87592 4.64507 9.47253 6.59772 8.97043 10.1455 12.6493 11.8721 17.1394 9.33865 numMergedOcc 0
7 mol 115 unq 1 iso 0 dist 5.87592 4.64507 9.47253 6.59772 8.97043 10.1455 4.98864 5.19652 9.54842 6.11741 numMergedOcc 0
8 mol 115 unq 2 iso 0 dist 8.37388 6.90898 9.47253 4.86477 8.97043 10.1455 13.7044 11.8721 17.1394 9.33865 numMergedOcc 0
9 mol 115 unq 3 iso 0 dist 8.37388 6.90898 9.47253 4.86477 8.97043 10.1455 7.95871 5.19652 9.54842 6.11741 numMergedOcc 0
10 mol 125 unq 0 iso 0 dist 8.12448 4.2009 8.48363 4.71345 6.03557 6.10523 12.3235 5.14495 12.6769 8.62381 numMergedOcc 0
11 mol 129 unq 0 iso 0 dist 9.66828 7.7205 7.26325 7.59962 6.23966 5.12351 13.8631 5.16275 12.0652 9.61051 numMergedOcc 0
12 mol 129 unq 1 iso 0 dist 9.66828 7.7205 7.26325 7.59962 6.23966 5.12351 12.5845 6.65856 6.42706 5.83384 numMergedOcc 0
13 mol 155 unq 0 iso 0 dist 6.80942 4.90139 8.3622 4.94973 5.68636 8.78324 11.1867 7.92939 14.5301 6.43582 numMergedOcc 0
14 mol 230 unq 0 iso 0 dist 8.95575 3.97555 9.32781 8.898 5.62804 9.33469 11.8177 6.33989 10.0551 6.7547 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 5.83646 5.64173 7.75366 5.60375 4.87108 10.3683 10.9193 7.45873 14.2408 6.22714 numMergedOcc 0
16 mol 238 unq 1 iso 0 dist 5.83646 5.64173 7.75366 6.45589 7.64276 10.313 10.9193 7.45873 14.2408 7.31233 numMergedOcc 0
17 mol 256 unq 0 iso 0 dist 8.88264 4.47286 9.92947 6.4717 5.98967 4.85574 12.8383 6.64029 12.7898 8.29103 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 6.41167 5.66907 8.73425 7.52881 8.21585 5.90131 5.73834 5.13233 9.04358 6.42289 numMergedOcc 0
19 mol 258 unq 1 iso 0 dist 6.41167 9.6053 9.65711 7.52881 8.21585 4.51422 5.73834 5.13233 10.0455 6.42289 numMergedOcc 0
20 mol 280 unq 0 iso 0 dist 4.26671 4.65268 6.38295 10.0206 8.80588 8.26589 9.16248 8.30978 5.41639 6.53701 numMergedOcc 0
21 mol 280 unq 1 iso 0 dist 4.26671 4.65268 6.38295 10.0206 8.80588 8.26589 9.02427 5.80223 7.96485 6.0664 numMergedOcc 0
