0 mol 25 unq 0 iso 0 dist 7.05148 8.27137 11.0175 5.59268 7.92503 4.79873 13.4236 10.2758 12.7147 9.48085 numMergedOcc 0
1 mol 78 unq 0 iso 0 dist 9.4486 7.32064 8.39195 7.17843 11.4999 6.85523 5.85007 7.71963 8.2592 5.77326 numMergedOcc 0
2 mol 78 unq 1 iso 0 dist 9.4486 7.32064 8.39195 13.1649 15.5721 8.65848 14.2511 15.7402 7.95975 7.25801 numMergedOcc 0
3 mol 78 unq 2 iso 0 dist 9.4486 5.85007 7.71963 7.17843 11.4999 5.77326 7.32064 8.39195 8.2592 6.85523 numMergedOcc 0
4 mol 95 unq 0 iso 0 dist 9.49995 9.70292 5.88327 5.69671 9.49454 8.57395 12.0576 15.7954 11.734 8.27883 numMergedOcc 0
5 mol 95 unq 1 iso 0 dist 9.49995 9.70292 5.88327 5.69671 9.49454 8.57395 10.4457 10.4348 6.95874 5.75428 numMergedOcc 0
6 mol 95 unq 2 iso 0 dist 9.49995 9.70292 5.88327 5.69671 9.49454 8.57395 9.59704 3.96826 9.43547 9.85409 numMergedOcc 0
7 mol 95 unq 3 iso 0 dist 9.49995 9.59704 3.96826 5.69671 9.49454 9.85409 12.0576 15.7954 17.4304 8.27883 numMergedOcc 0
8 mol 95 unq 4 iso 0 dist 9.49995 9.59704 3.96826 5.69671 9.49454 9.85409 10.4457 10.4348 12.3063 5.75428 numMergedOcc 0
9 mol 95 unq 5 iso 0 dist 9.49995 9.59704 3.96826 5.69671 9.49454 9.85409 9.70292 5.88327 9.43547 8.57395 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 9.25249 8.3505 17.4008 10.4417 17.8091 5.92242 7.34638 11.5696 9.6331 7.02507 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 9.25249 8.3505 17.4008 11.3628 19.9118 5.2571 14.2657 23.5127 6.70343 7.54889 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 9.25249 8.3505 17.4008 13.9599 22.4773 8.7497 14.2657 23.5127 6.70343 7.78931 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 9.25249 7.34638 11.5696 10.4417 17.8091 7.02507 8.3505 17.4008 9.6331 5.92242 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 5.94696 5.08983 3.92737 7.1452 4.47349 7.54889 9.58039 3.94967 6.70343 5.2571 numMergedOcc 0
15 mol 98 unq 5 iso 0 dist 5.94696 5.08983 3.92737 4.96747 5.65185 7.78931 9.58039 3.94967 6.70343 8.7497 numMergedOcc 0
16 mol 109 unq 0 iso 0 dist 8.48774 6.67635 7.60413 10.0698 13.0672 7.86666 13.1156 13.0165 7.49425 6.29161 numMergedOcc 0
17 mol 112 unq 0 iso 0 dist 6.09626 4.77996 5.08111 4.34071 9.28592 5.56994 9.80187 8.72143 5.11 9.05166 numMergedOcc 0
18 mol 167 unq 0 iso 0 dist 9.14629 8.77904 8.91275 6.64464 11.6896 7.68266 6.48993 5.95858 3.55199 6.84752 numMergedOcc 0
19 mol 167 unq 1 iso 0 dist 9.14629 8.77904 8.91275 5.70785 12.8466 7.6616 6.48993 5.95858 3.55199 7.86563 numMergedOcc 0
20 mol 167 unq 2 iso 0 dist 9.14629 8.77904 8.91275 7.91498 9.67741 9.2289 11.1687 5.43662 9.25262 7.20495 numMergedOcc 0
21 mol 167 unq 3 iso 0 dist 9.14629 8.77904 8.91275 7.91498 9.67741 9.2289 6.48993 5.95858 3.55199 7.02548 numMergedOcc 0
22 mol 167 unq 4 iso 0 dist 9.14629 6.48993 5.95858 6.64464 11.6896 6.84752 8.77904 8.91275 3.55199 7.68266 numMergedOcc 0
23 mol 167 unq 5 iso 0 dist 9.14629 6.48993 5.95858 5.70785 12.8466 7.86563 8.77904 8.91275 3.55199 7.6616 numMergedOcc 0
24 mol 167 unq 6 iso 0 dist 9.14629 6.48993 5.95858 7.91498 9.67741 7.02548 11.1687 5.43662 6.81449 7.20495 numMergedOcc 0
25 mol 167 unq 7 iso 0 dist 9.14629 6.48993 5.95858 7.91498 9.67741 7.02548 8.77904 8.91275 3.55199 9.2289 numMergedOcc 0
26 mol 184 unq 0 iso 0 dist 8.95598 8.27396 4.67256 4.41193 6.42735 5.96423 10.1839 3.7949 5.33725 8.97589 numMergedOcc 0
27 mol 223 unq 0 iso 0 dist 7.81769 9.6936 3.86668 8.78003 7.48463 9.33543 14.1948 10.5752 12.841 6.42257 numMergedOcc 0
28 mol 223 unq 1 iso 0 dist 7.66694 9.36733 3.86668 5.33327 7.48463 9.33543 11.4037 10.5752 12.841 6.42257 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 9.11072 4.97796 13.3632 4.56913 12.2077 6.4611 8.97249 9.78219 13.5848 9.30212 numMergedOcc 0
30 mol 274 unq 1 iso 0 dist 6.83113 4.97796 5.39432 4.56913 10.5387 6.4611 8.97249 15.1209 13.5848 9.30212 numMergedOcc 0
31 mol 274 unq 2 iso 0 dist 9.44134 4.97796 10.7442 4.56913 13.9123 6.4611 8.97249 13.9324 13.5848 9.30212 numMergedOcc 0
32 mol 274 unq 3 iso 0 dist 9.02071 7.15079 9.78219 4.37547 12.2077 9.30212 9.39896 13.3632 13.5848 6.4611 numMergedOcc 0
33 mol 292 unq 0 iso 0 dist 6.68863 5.72473 6.32259 8.04474 11.4575 7.20674 12.7549 15.433 9.14614 8.38121 numMergedOcc 0
