0 mol 6 unq 0 iso 0 dist 9.31066 9.70457 8.76009 5.4574 12.2846 8.8237 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 9.93488 9.63221 5.68808 4.87006 11.3571 9.42165 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.61711 8.52017 6.12084 4.45291 9.81698 6.95457 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.99509 4.44406 8.42544 9.36678 15.7633 9.97844 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 8.47617 4.44406 6.09486 9.36678 12.5893 9.97844 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 5.73331 4.44406 4.40385 9.36678 13.8701 9.97844 numMergedOcc 0
6 mol 43 unq 4 iso 0 dist 8.48694 4.44406 6.2847 9.36678 15.4019 9.97844 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 8.07716 5.77889 8.57859 7.09667 14.7609 8.6092 numMergedOcc 0
8 mol 81 unq 1 iso 0 dist 8.07716 6.91587 11.453 13.9016 15.0997 8.82476 numMergedOcc 0
9 mol 81 unq 2 iso 0 dist 8.07716 6.91587 11.453 12.5083 18.1216 9.78923 numMergedOcc 0
10 mol 81 unq 3 iso 0 dist 8.07716 6.91587 11.453 7.09667 14.7609 6.38981 numMergedOcc 0
11 mol 81 unq 4 iso 0 dist 5.78829 8.22976 8.57859 12.1659 14.7609 8.6092 numMergedOcc 0
12 mol 81 unq 5 iso 0 dist 5.78829 8.9512 11.453 10.6966 15.0997 8.82476 numMergedOcc 0
13 mol 81 unq 6 iso 0 dist 5.78829 8.9512 11.453 13.1407 18.1216 9.78923 numMergedOcc 0
14 mol 81 unq 7 iso 0 dist 5.78829 8.9512 11.453 12.1659 14.7609 6.38981 numMergedOcc 0
15 mol 89 unq 0 iso 0 dist 5.25504 6.2836 4.30591 6.28243 6.36021 9.63477 numMergedOcc 0
16 mol 89 unq 1 iso 0 dist 7.84991 6.2836 5.1661 6.28243 12.5644 9.63477 numMergedOcc 0
17 mol 132 unq 0 iso 0 dist 7.84864 8.96089 9.48616 9.98904 13.7853 7.17412 numMergedOcc 0
18 mol 196 unq 0 iso 0 dist 4.97115 5.66536 10.1657 11.0772 15.2399 9.03055 numMergedOcc 0
19 mol 196 unq 1 iso 0 dist 9.45804 5.66536 11.4143 11.0772 18.2722 9.03055 numMergedOcc 0
20 mol 196 unq 2 iso 0 dist 9.8486 5.66536 8.29433 11.0772 13.8582 9.03055 numMergedOcc 0
21 mol 196 unq 3 iso 0 dist 7.23126 5.66536 3.98793 11.0772 12.5376 9.03055 numMergedOcc 0
22 mol 196 unq 4 iso 0 dist 7.82805 6.55775 3.98793 7.71979 12.5376 9.03055 numMergedOcc 0
23 mol 197 unq 0 iso 0 dist 9.14737 8.56661 14.465 4.31461 11.0336 6.04056 numMergedOcc 0
24 mol 197 unq 1 iso 0 dist 9.14737 6.20676 10.8461 4.31461 11.0336 5.5343 numMergedOcc 0
25 mol 197 unq 2 iso 0 dist 9.14737 7.36576 4.91336 4.31461 11.0336 8.8252 numMergedOcc 0
26 mol 220 unq 0 iso 0 dist 6.93717 7.39796 3.91796 8.26463 8.48112 5.05353 numMergedOcc 0
27 mol 247 unq 0 iso 0 dist 8.14191 6.16117 8.09099 6.67746 11.4541 6.50869 numMergedOcc 0
28 mol 247 unq 1 iso 0 dist 8.14191 6.16117 8.09099 9.74878 16.6084 9.54682 numMergedOcc 0
29 mol 257 unq 0 iso 0 dist 8.95261 8.13651 8.14464 7.76381 14.1093 9.75866 numMergedOcc 0
30 mol 257 unq 1 iso 0 dist 7.80336 7.70445 8.14464 6.91217 14.1093 9.75866 numMergedOcc 0
31 mol 259 unq 0 iso 0 dist 5.29682 8.42773 4.51538 10.7991 10.3594 8.14526 numMergedOcc 0
32 mol 259 unq 1 iso 0 dist 5.29682 8.42773 4.51538 4.98212 6.77279 7.94491 numMergedOcc 0
33 mol 259 unq 2 iso 0 dist 5.29682 8.42773 4.51538 13.0438 11.5101 7.75803 numMergedOcc 0
34 mol 259 unq 3 iso 0 dist 6.20344 8.42773 9.08426 10.7991 13.8212 8.14526 numMergedOcc 0
35 mol 259 unq 4 iso 0 dist 6.20344 8.42773 9.08426 4.98212 9.58006 7.94491 numMergedOcc 0
36 mol 259 unq 5 iso 0 dist 6.20344 8.42773 9.08426 13.0438 15.8133 7.75803 numMergedOcc 0
