0 mol 7 unq 0 iso 0 dist 5.77374 9.8603 5.70161 9.33944 8.0166 6.22805 14.6665 12.2471 7.10621 6.96396 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.57437 9.8603 4.57188 10.0257 9.67498 13.9815 14.6665 10.2729 7.10621 19.4202 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.57437 9.8603 4.57188 9.33944 9.32945 6.22805 14.6665 10.2729 7.10621 6.96396 numMergedOcc 0
3 mol 14 unq 0 iso 0 dist 9.42142 8.13983 7.00835 5.06934 7.66311 8.91266 5.63648 8.39221 6.38364 4.15151 numMergedOcc 0
4 mol 16 unq 0 iso 0 dist 9.56648 6.36377 5.35079 10.143 7.88676 10.8592 4.78943 9.18436 5.05803 12.558 numMergedOcc 0
5 mol 16 unq 1 iso 0 dist 9.56648 6.36377 5.35079 10.143 7.88676 10.8592 5.48395 5.84479 6.31718 5.66097 numMergedOcc 0
6 mol 51 unq 0 iso 0 dist 6.50216 7.12423 5.27155 10.8401 7.95419 9.06397 13.6102 13.9156 9.0709 12.8917 numMergedOcc 0
7 mol 61 unq 0 iso 0 dist 9.67403 8.46556 11.5608 8.24748 8.30431 12.3891 4.90701 9.62468 6.72123 6.32949 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 5.58346 6.18305 5.2774 7.53682 5.39171 6.30194 4.69583 6.89722 6.19304 10.5627 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 9.10386 6.18305 5.44275 7.53682 9.27355 6.30194 4.69583 7.26679 6.19304 10.5627 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 7.66832 8.73648 5.5332 9.79203 8.59182 13.6568 9.47324 8.21889 7.34473 12.4009 numMergedOcc 0
11 mol 109 unq 1 iso 0 dist 7.66832 8.73648 5.5332 9.79203 8.59182 13.6568 4.93112 9.74643 8.58044 12.8701 numMergedOcc 0
12 mol 109 unq 2 iso 0 dist 7.66832 8.73648 5.5332 9.79203 8.59182 13.6568 4.48038 6.86702 9.97763 5.95831 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 6.85651 9.3894 8.00493 8.75242 9.07294 15.4604 4.84607 8.84018 6.5107 13.1243 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 6.85651 9.3894 8.00493 8.75242 9.07294 15.4604 13.0836 15.1254 9.52634 18.5054 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 6.85651 9.3894 8.00493 14.0828 7.50126 12.9713 4.84607 8.84018 6.5107 15.9524 numMergedOcc 0
16 mol 133 unq 3 iso 0 dist 6.85651 9.3894 8.00493 14.0828 7.50126 12.9713 13.0836 15.1254 9.52634 19.8715 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 6.14732 9.07872 13.552 7.27568 5.2851 12.5006 9.9474 14.5974 7.09863 11.672 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 9.46728 8.59074 16.5687 4.13744 5.57184 11.7876 9.18011 16.0821 5.72887 11.2453 numMergedOcc 0
19 mol 238 unq 1 iso 0 dist 9.91921 6.2365 6.62361 6.12122 6.74214 7.98022 4.7157 9.31417 5.72887 6.3873 numMergedOcc 0
20 mol 238 unq 2 iso 0 dist 8.20243 6.2365 5.96552 6.12122 5.33462 7.98022 4.7157 5.56719 5.72887 6.3873 numMergedOcc 0
21 mol 241 unq 0 iso 0 dist 8.15897 9.18476 4.86437 6.70277 9.174 6.40592 9.87799 9.72526 7.4631 7.93809 numMergedOcc 0
22 mol 249 unq 0 iso 0 dist 7.279 6.37672 9.82483 5.4063 4.46389 10.516 9.07501 15.3404 7.57994 13.8666 numMergedOcc 0
23 mol 249 unq 1 iso 0 dist 7.279 6.37672 9.82483 5.4063 4.46389 10.516 4.24014 11.128 6.18582 9.13005 numMergedOcc 0
24 mol 249 unq 2 iso 0 dist 8.43448 8.94023 9.82483 5.26413 4.46389 10.516 9.53929 15.3404 7.57994 13.8666 numMergedOcc 0
25 mol 249 unq 3 iso 0 dist 8.43448 8.94023 9.82483 5.26413 4.46389 10.516 5.36989 11.128 6.18582 9.13005 numMergedOcc 0
26 mol 258 unq 0 iso 0 dist 9.4886 5.73834 8.31011 12.1075 8.57305 14.6694 6.48867 12.9664 6.60405 17.3656 numMergedOcc 0
27 mol 258 unq 1 iso 0 dist 9.4886 5.73834 8.31011 12.1075 8.57305 14.6694 7.52881 14.2477 6.42289 18.9951 numMergedOcc 0
28 mol 259 unq 0 iso 0 dist 5.98006 8.06771 5.71237 7.78289 8.73077 11.4871 6.64729 6.77279 8.13497 13.6207 numMergedOcc 0
29 mol 259 unq 1 iso 0 dist 5.98006 8.06771 5.71237 7.78289 8.73077 11.4871 9.79538 9.58006 7.88519 16.6797 numMergedOcc 0
30 mol 259 unq 2 iso 0 dist 5.98006 8.06771 5.71237 5.73217 6.76656 6.96379 6.64729 6.77279 8.13497 10.908 numMergedOcc 0
31 mol 259 unq 3 iso 0 dist 5.98006 8.06771 5.71237 5.73217 6.76656 6.96379 9.79538 9.58006 7.88519 12.7595 numMergedOcc 0
32 mol 259 unq 4 iso 0 dist 7.97113 9.12507 13.3027 6.92619 8.91916 14.9752 5.59901 10.0766 5.30224 12.3834 numMergedOcc 0
33 mol 259 unq 5 iso 0 dist 5.22111 9.12507 12.3218 9.98638 9.45077 18.9727 5.59901 9.52383 5.30224 15.3022 numMergedOcc 0
34 mol 259 unq 6 iso 0 dist 5.22111 9.12507 12.3218 6.92619 4.55368 14.9752 5.59901 9.52383 5.30224 12.3834 numMergedOcc 0
35 mol 279 unq 0 iso 0 dist 9.71653 7.74162 6.03718 6.05412 8.57035 5.17586 9.5773 14.3672 9.70696 5.9229 numMergedOcc 0
