0 mol 7 unq 0 iso 0 dist 6.22892 12.1855 9.87885 14.5008 13.2247 6.1206 14.6751 10.5461 7.12508 7.10621 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.22805 12.2255 9.67164 13.3926 12.2041 5.99459 15.2825 10.5461 6.88805 8.41585 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 9.04834 5.37568 7.65889 8.17898 10.2656 6.42835 5.72175 11.6856 5.01101 5.05803 numMergedOcc 0
3 mol 16 unq 1 iso 0 dist 8.17898 5.37568 6.42835 9.04834 10.2656 7.65889 6.05535 11.0958 6.86055 4.7319 numMergedOcc 0
4 mol 16 unq 2 iso 0 dist 8.17898 9.62324 6.57331 10.6491 6.92781 8.43054 5.72175 5.05803 4.65873 6.31718 numMergedOcc 0
5 mol 16 unq 3 iso 0 dist 8.17898 9.62324 6.57331 10.6491 6.92781 8.43054 16.2171 12.5273 9.81307 7.63133 numMergedOcc 0
6 mol 25 unq 0 iso 0 dist 8.23292 10.985 9.49421 17.4517 10.9391 9.48085 15.8887 12.7009 5.18617 7.57578 numMergedOcc 0
7 mol 25 unq 1 iso 0 dist 8.23292 10.985 9.49421 17.4517 10.9391 9.48085 16.0361 12.8117 5.68041 7.17969 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.30194 11.1632 7.4369 10.392 5.4148 9.73086 10.5627 6.19304 5.70116 9.96396 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 6.30194 11.1632 7.4369 10.392 5.4148 9.73086 10.8067 10.2049 17.4121 9.38498 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 6.30194 11.1632 7.4369 10.392 5.4148 9.73086 17.4113 11.6369 14.844 9.75218 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 5.79954 11.5216 9.73086 10.4766 5.4148 7.4369 12.8388 9.96396 5.70116 6.19304 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 7.01889 16.3376 9.73086 10.997 5.4148 7.4369 15.0744 9.96396 5.70116 6.19304 numMergedOcc 0
13 mol 88 unq 0 iso 0 dist 9.25163 3.42334 7.51139 10.751 12.1547 7.80898 14.1102 16.8013 12.1193 9.36773 numMergedOcc 0
14 mol 109 unq 0 iso 0 dist 7.4371 5.28562 9.77497 11.898 17.2949 7.86666 14.8792 21.5605 13.0886 7.34473 numMergedOcc 0
15 mol 112 unq 0 iso 0 dist 8.35164 6.13615 9.02706 9.43616 4.8896 8.47988 10.746 11.5121 6.95317 7.71338 numMergedOcc 0
16 mol 112 unq 1 iso 0 dist 8.35164 4.49971 9.39168 9.43616 4.8896 8.0427 10.746 11.5121 7.57713 7.71338 numMergedOcc 0
17 mol 132 unq 0 iso 0 dist 8.34869 11.6543 7.89457 6.2403 4.35917 6.89918 6.04014 11.5751 12.9631 7.7059 numMergedOcc 0
18 mol 132 unq 1 iso 0 dist 9.43748 7.05332 7.89457 6.495 4.35917 6.89918 10.0823 11.5751 12.9631 7.7059 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 7.15203 5.94578 8.26547 11.0475 5.61668 9.05342 9.71227 8.22656 4.88025 6.82262 numMergedOcc 0
20 mol 134 unq 0 iso 0 dist 5.67862 10.8891 7.93372 10.738 5.49782 7.21868 9.52819 6.37586 8.06642 8.94367 numMergedOcc 0
21 mol 134 unq 1 iso 0 dist 5.67862 10.8891 7.93372 10.738 5.49782 7.21868 12.4156 9.71307 4.00092 9.86662 numMergedOcc 0
22 mol 170 unq 0 iso 0 dist 7.15418 10.4801 9.08274 14.7831 8.56034 9.51256 15.2278 12.8281 4.78249 9.76807 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 7.25658 4.69994 6.99769 10.8312 6.77699 8.79428 9.17439 10.103 7.05804 6.57273 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 7.25658 4.69994 6.99769 10.8312 6.77699 8.79428 5.38198 6.65832 5.76843 6.60589 numMergedOcc 0
25 mol 224 unq 2 iso 0 dist 7.25658 4.69994 6.99769 11.1589 11.328 6.8692 9.17439 10.103 7.05804 5.78342 numMergedOcc 0
26 mol 224 unq 3 iso 0 dist 7.25658 4.69994 6.99769 11.1589 11.328 6.8692 5.38198 6.65832 5.76843 9.16166 numMergedOcc 0
27 mol 224 unq 4 iso 0 dist 7.25658 4.69994 6.99769 11.1589 11.328 6.8692 7.13322 10.9745 4.54188 5.81334 numMergedOcc 0
28 mol 229 unq 0 iso 0 dist 8.0007 6.80826 6.95201 12.776 7.0298 7.27993 12.1346 11.7165 5.70473 8.22528 numMergedOcc 0
29 mol 229 unq 1 iso 0 dist 8.0007 6.80826 6.95201 12.776 7.0298 7.27993 13.3828 11.4362 7.22525 7.03423 numMergedOcc 0
30 mol 234 unq 0 iso 0 dist 9.67966 5.07724 5.64285 11.6069 10.2693 7.81215 12.6357 17.458 12.4252 9.45496 numMergedOcc 0
31 mol 234 unq 1 iso 0 dist 9.67966 5.07724 5.64285 11.6069 10.2693 7.81215 6.2634 10.701 5.75498 6.7625 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 6.96379 8.41608 9.46361 11.1532 6.96053 6.95511 12.7595 7.88519 11.6988 7.46176 numMergedOcc 0
33 mol 280 unq 0 iso 0 dist 9.26066 8.13853 6.02353 12.5331 5.51836 6.86234 12.5899 6.53701 4.90315 6.0664 numMergedOcc 0
