0 mol 5 unq 0 iso 0 dist 9.22027 7.56229 3.33561 3.14155 7.50453 5.69239 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 9.22027 7.50453 3.14155 3.33561 7.56229 5.69239 numMergedOcc 0
2 mol 5 unq 2 iso 0 dist 4.98321 7.74636 6.98653 5.31713 8.87945 7.64769 numMergedOcc 0
3 mol 5 unq 3 iso 0 dist 4.98321 7.74636 6.98653 7.84244 11.532 8.31759 numMergedOcc 0
4 mol 5 unq 4 iso 0 dist 4.98321 8.87945 5.31713 6.98653 7.74636 7.64769 numMergedOcc 0
5 mol 5 unq 5 iso 0 dist 4.98321 8.87945 5.31713 10.4477 10.433 8.68577 numMergedOcc 0
6 mol 5 unq 6 iso 0 dist 4.98321 8.87945 5.31713 9.22937 10.8912 9.70883 numMergedOcc 0
7 mol 10 unq 0 iso 0 dist 7.14537 6.77807 4.68389 8.56896 9.89713 8.7908 numMergedOcc 0
8 mol 10 unq 1 iso 0 dist 9.39486 6.77807 7.73435 8.56896 15.7648 8.7908 numMergedOcc 0
9 mol 29 unq 0 iso 0 dist 5.09702 5.99655 3.44035 8.80559 11.2439 9.2087 numMergedOcc 0
10 mol 68 unq 0 iso 0 dist 5.7369 8.71074 10.1736 7.18877 11.7921 7.7485 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 9.08825 5.45099 5.16522 3.35924 12.0937 7.66068 numMergedOcc 0
12 mol 76 unq 1 iso 0 dist 9.08825 8.44765 9.60553 3.35924 12.0937 9.5043 numMergedOcc 0
13 mol 76 unq 2 iso 0 dist 9.08825 9.06643 12.9855 3.35924 12.0937 8.34132 numMergedOcc 0
14 mol 79 unq 0 iso 0 dist 8.7515 4.74254 11.3271 7.19532 14.9757 6.20144 numMergedOcc 0
15 mol 93 unq 0 iso 0 dist 7.23305 7.39732 3.09636 4.98621 10.7925 9.66837 numMergedOcc 0
16 mol 107 unq 0 iso 0 dist 6.11492 7.91251 10.4294 5.88785 6.49371 8.88124 numMergedOcc 0
17 mol 107 unq 1 iso 0 dist 6.11492 9.09262 3.40943 5.88785 6.49371 8.19484 numMergedOcc 0
18 mol 107 unq 2 iso 0 dist 6.11492 6.49371 5.88785 10.4294 7.91251 8.88124 numMergedOcc 0
19 mol 107 unq 3 iso 0 dist 6.11492 6.49371 5.88785 3.40943 9.09262 8.19484 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 9.29944 6.60366 10.4448 5.94217 12.5751 4.3855 numMergedOcc 0
21 mol 158 unq 0 iso 0 dist 9.10671 9.44964 5.09517 5.70869 10.6196 7.97228 numMergedOcc 0
22 mol 168 unq 0 iso 0 dist 8.32353 6.53038 8.60565 10.7133 14.451 5.86767 numMergedOcc 0
23 mol 168 unq 1 iso 0 dist 8.32353 6.53038 8.60565 6.65321 11.9693 5.28353 numMergedOcc 0
24 mol 204 unq 0 iso 0 dist 9.26214 8.23717 9.94456 5.80328 12.5711 8.32259 numMergedOcc 0
25 mol 204 unq 1 iso 0 dist 9.26214 8.23717 9.94456 3.68217 10.3857 8.54737 numMergedOcc 0
26 mol 204 unq 2 iso 0 dist 9.26214 7.98864 8.03752 5.80328 12.5711 9.93489 numMergedOcc 0
27 mol 204 unq 3 iso 0 dist 9.26214 7.98864 8.03752 3.68217 10.3857 7.64057 numMergedOcc 0
28 mol 204 unq 4 iso 0 dist 5.00369 8.23717 4.7839 5.80328 7.33774 8.32259 numMergedOcc 0
29 mol 204 unq 5 iso 0 dist 5.00369 8.23717 4.7839 3.68217 6.39122 8.54737 numMergedOcc 0
30 mol 204 unq 6 iso 0 dist 5.00369 7.98864 4.05102 5.80328 7.33774 9.93489 numMergedOcc 0
31 mol 204 unq 7 iso 0 dist 5.00369 7.98864 4.05102 3.68217 6.39122 7.64057 numMergedOcc 0
32 mol 204 unq 8 iso 0 dist 5.00369 7.33774 5.80328 4.7839 8.23717 8.32259 numMergedOcc 0
33 mol 204 unq 9 iso 0 dist 5.00369 7.33774 5.80328 4.05102 7.98864 9.93489 numMergedOcc 0
34 mol 204 unq 10 iso 0 dist 5.00369 6.39122 3.68217 4.7839 8.23717 8.54737 numMergedOcc 0
35 mol 204 unq 11 iso 0 dist 5.00369 6.39122 3.68217 4.05102 7.98864 7.64057 numMergedOcc 0
36 mol 214 unq 0 iso 0 dist 8.25329 9.59928 4.84709 3.14057 8.49349 8.66082 numMergedOcc 0
37 mol 214 unq 1 iso 0 dist 8.25329 9.59928 4.84709 8.88633 6.50654 7.96338 numMergedOcc 0
38 mol 214 unq 2 iso 0 dist 8.25329 8.49349 3.14057 4.84709 9.59928 8.66082 numMergedOcc 0
39 mol 214 unq 3 iso 0 dist 8.25329 6.50654 8.88633 4.84709 9.59928 7.96338 numMergedOcc 0
40 mol 214 unq 4 iso 0 dist 8.25329 6.50654 8.88633 4.16963 11.1063 7.42759 numMergedOcc 0
41 mol 214 unq 5 iso 0 dist 4.85332 7.70062 4.84709 7.87816 8.49349 8.66082 numMergedOcc 0
42 mol 214 unq 6 iso 0 dist 4.85332 7.70062 4.84709 3.64285 6.50654 7.96338 numMergedOcc 0
43 mol 214 unq 7 iso 0 dist 4.85332 7.66702 4.16963 3.64285 6.50654 7.42759 numMergedOcc 0
44 mol 214 unq 8 iso 0 dist 4.85332 8.49349 7.87816 4.84709 7.70062 8.66082 numMergedOcc 0
45 mol 214 unq 9 iso 0 dist 4.85332 6.50654 3.64285 4.84709 7.70062 7.96338 numMergedOcc 0
46 mol 214 unq 10 iso 0 dist 4.85332 6.50654 3.64285 4.16963 7.66702 7.42759 numMergedOcc 0
47 mol 243 unq 0 iso 0 dist 8.30024 9.53137 8.97648 7.66826 11.0685 4.55853 numMergedOcc 0
48 mol 243 unq 1 iso 0 dist 8.20943 9.53137 14.0671 7.66826 14.5062 4.55853 numMergedOcc 0
49 mol 277 unq 0 iso 0 dist 7.16209 5.13533 5.9732 10.5214 13.9096 7.98956 numMergedOcc 0
50 mol 277 unq 1 iso 0 dist 4.62936 5.13533 3.79766 10.5214 11.5963 7.98956 numMergedOcc 0
