0 mol 43 unq 0 iso 0 dist 9.16827 12.092 6.20293 20.8715 14.445 9.74445 18.5268 9.49077 9.83618 12.8035 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 9.99643 8.2572 6.72123 10.0527 11.5608 9.62468 12.3867 7.39396 8.76003 6.91052 numMergedOcc 0
2 mol 61 unq 1 iso 0 dist 9.99643 8.2572 6.72123 12.5256 10.1513 5.92705 12.3867 7.39396 8.76003 7.34319 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 5.89394 6.80709 7.4729 14.7682 11.8037 9.514 10.2494 6.99832 5.81965 5.02124 numMergedOcc 0
4 mol 127 unq 0 iso 0 dist 9.79448 6.02237 9.30299 6.46753 9.75166 8.40046 10.4933 4.77464 9.81878 7.34983 numMergedOcc 0
5 mol 156 unq 0 iso 0 dist 7.80643 6.52984 7.44554 8.46837 5.0966 7.30021 9.89595 7.29758 6.27641 10.3893 numMergedOcc 0
6 mol 175 unq 0 iso 0 dist 8.50904 8.09861 9.0018 10.6965 11.5099 8.69888 14.6406 8.22779 9.8589 14.6255 numMergedOcc 0
7 mol 175 unq 1 iso 0 dist 8.50904 8.09861 9.0018 12.0647 12.1783 5.08206 14.6406 8.22779 9.8589 11.5085 numMergedOcc 0
8 mol 175 unq 2 iso 0 dist 7.04318 8.09861 5.6234 10.6965 5.50014 8.69888 14.6406 10.5631 9.8589 14.6255 numMergedOcc 0
9 mol 175 unq 3 iso 0 dist 7.04318 8.09861 5.6234 12.0647 7.28617 5.08206 14.6406 10.5631 9.8589 11.5085 numMergedOcc 0
10 mol 178 unq 0 iso 0 dist 6.01118 9.73148 6.69288 11.0304 12.2822 8.0974 13.3172 10.5783 8.96511 11.6559 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 8.93637 14.8074 9.23153 21.6232 14.6296 7.31105 10.22 6.7067 6.84247 12.3402 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 8.93637 14.8074 9.23153 21.6232 14.6296 7.31105 19.9234 15.9568 6.99002 7.84277 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.82174 10.4397 6.57393 11.5665 10.8336 6.83152 6.54661 6.20606 5.38637 6.03021 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 9.2521 10.1821 7.31233 11.5665 12.1448 5.24313 6.54661 10.4664 6.55759 6.03021 numMergedOcc 0
15 mol 238 unq 2 iso 0 dist 9.2521 10.1821 7.31233 11.5665 12.1448 5.24313 8.97261 11.2717 7.02475 5.27451 numMergedOcc 0
16 mol 238 unq 3 iso 0 dist 9.2521 10.1821 7.31233 11.5665 12.1448 5.24313 13.7887 12.6986 7.67322 6.23871 numMergedOcc 0
17 mol 238 unq 4 iso 0 dist 9.2521 10.1821 7.31233 11.5665 12.1448 5.24313 12.0613 5.17471 7.19008 11.3884 numMergedOcc 0
18 mol 248 unq 0 iso 0 dist 8.34646 6.21372 8.2965 14.594 11.762 8.71859 11.6569 9.29921 6.07192 4.11367 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 6.49599 13.8605 7.88519 10.3275 5.71237 9.58006 15.0738 11.6195 7.48005 15.1483 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 9.34738 13.8605 7.84554 10.3275 9.10984 9.58006 15.0738 11.8736 7.48005 15.1483 numMergedOcc 0
21 mol 259 unq 2 iso 0 dist 9.47382 13.8605 7.46176 10.3275 11.8501 9.58006 15.0738 5.79468 7.48005 15.1483 numMergedOcc 0
22 mol 276 unq 0 iso 0 dist 7.11272 5.75852 6.87396 13.5901 8.86096 9.05218 7.3327 6.4102 8.76347 11.6861 numMergedOcc 0
23 mol 282 unq 0 iso 0 dist 7.70229 8.93697 8.76532 9.40138 4.58403 5.67266 14.2443 8.14825 8.8673 5.41716 numMergedOcc 0
24 mol 282 unq 1 iso 0 dist 7.70229 8.93697 8.76532 13.9846 10.5698 5.80981 14.2443 8.14825 8.8673 5.37323 numMergedOcc 0
25 mol 282 unq 2 iso 0 dist 7.70229 8.93697 8.76532 10.9385 13.108 9.63346 14.2443 8.14825 8.8673 14.5422 numMergedOcc 0
26 mol 282 unq 3 iso 0 dist 7.90792 8.93697 6.33524 9.40138 5.04235 5.67266 14.2443 7.36881 8.8673 5.41716 numMergedOcc 0
27 mol 282 unq 4 iso 0 dist 7.90792 8.93697 6.33524 13.9846 8.37652 5.80981 14.2443 7.36881 8.8673 5.37323 numMergedOcc 0
28 mol 282 unq 5 iso 0 dist 7.90792 8.93697 6.33524 10.9385 8.85797 9.63346 14.2443 7.36881 8.8673 14.5422 numMergedOcc 0
