0 mol 16 unq 0 iso 0 dist 6.61114 6.75381 10.1658 6.50294 4.86568 10.977 10.212 6.62144 15.6426 5.39089 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.75381 6.61114 10.1658 5.50193 4.7319 11.061 10.3873 6.72833 15.8759 6.51133 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 8.50987 9.27448 9.85159 6.44262 6.03987 11.0377 4.95472 6.85556 12.5185 5.68392 numMergedOcc 0
3 mol 25 unq 1 iso 0 dist 8.50987 9.07927 4.51512 6.44262 6.03987 7.31767 4.95472 6.85556 9.79094 5.68392 numMergedOcc 0
4 mol 101 unq 0 iso 0 dist 7.42893 8.23251 8.13019 5.81947 6.57035 12.0459 9.31844 6.98314 14.1773 5.53055 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 5.79411 9.9404 5.49089 6.03768 7.36792 12.8376 4.26679 8.31932 12.2794 7.42011 numMergedOcc 0
6 mol 115 unq 0 iso 0 dist 6.3982 6.61066 10.4152 5.29965 5.11551 11.5333 10.6104 6.92026 16.2704 6.77806 numMergedOcc 0
7 mol 134 unq 0 iso 0 dist 8.31743 8.5778 5.79898 10.2414 9.89303 6.54501 6.89623 5.83771 7.80532 7.41674 numMergedOcc 0
8 mol 134 unq 1 iso 0 dist 8.5778 8.31743 5.79898 10.2414 6.54501 9.89303 6.89623 7.80532 5.83771 7.41674 numMergedOcc 0
9 mol 134 unq 2 iso 0 dist 8.5778 8.31743 5.79898 13.5276 6.49416 9.93925 6.89623 7.80532 5.83771 9.87376 numMergedOcc 0
10 mol 234 unq 0 iso 0 dist 8.58958 7.17987 5.88703 16.0172 8.34494 12.9605 18.0206 9.81425 13.293 4.3717 numMergedOcc 0
11 mol 234 unq 1 iso 0 dist 8.58958 7.17987 5.88703 14.7629 6.56247 9.45496 18.0206 9.81425 13.293 4.46561 numMergedOcc 0
12 mol 234 unq 2 iso 0 dist 8.58958 7.17987 5.88703 13.5847 9.36357 6.7625 18.0206 9.81425 13.293 10.641 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 9.14351 9.0157 8.34718 12.1004 7.57994 11.7594 5.56847 5.48118 10.0024 10.7772 numMergedOcc 0
14 mol 249 unq 1 iso 0 dist 9.14351 9.0157 8.34718 9.40115 6.18582 12.2913 5.56847 5.48118 10.0024 7.04666 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 9.80417 8.26503 10.7374 10.759 6.60405 14.3043 5.62207 7.21311 9.96262 5.63675 numMergedOcc 0
16 mol 259 unq 0 iso 0 dist 9.89728 8.70852 7.64658 5.07898 7.46176 7.84554 13.5186 7.08526 11.6972 8.81835 numMergedOcc 0
17 mol 259 unq 1 iso 0 dist 9.89728 6.42437 10.5239 5.07898 7.46176 9.18903 13.5186 7.08526 15.8414 8.81835 numMergedOcc 0
18 mol 278 unq 0 iso 0 dist 8.62414 6.23184 8.29447 12.2316 8.44326 10.6095 10.5063 8.00673 6.62841 4.97614 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 6.87804 6.02089 11.8061 11.634 8.2734 17.2013 13.9059 7.07965 18.2597 10.8848 numMergedOcc 0
