0 mol 7 unq 0 iso 0 dist 6.02702 11.8172 8.72114 10.5551 6.04832 4.87279 6.55304 6.14469 6.34041 5.82034 numMergedOcc 0
1 mol 7 unq 0 iso 1 dist 8.72114 11.8172 6.02702 4.87279 6.04832 10.5551 6.34041 6.14469 6.55304 5.82034 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 7.32257 6.14147 6.55811 4.86982 6.17406 9.10873 8.50424 7.35972 6.02809 10.8146 numMergedOcc 0
3 mol 9 unq 0 iso 1 dist 6.55811 6.14147 7.32257 9.10873 6.17406 4.86982 6.02809 7.35972 8.50424 10.8146 numMergedOcc 0
4 mol 9 unq 1 iso 0 dist 7.32257 6.14147 6.55811 5.72062 7.2707 7.6565 8.50424 7.35972 6.02809 12.0297 numMergedOcc 0
5 mol 9 unq 1 iso 1 dist 6.55811 6.14147 7.32257 7.6565 7.2707 5.72062 6.02809 7.35972 8.50424 12.0297 numMergedOcc 0
6 mol 9 unq 2 iso 0 dist 7.32257 10.5747 8.64915 4.86982 6.17406 13.1204 8.50424 7.35972 4.98827 10.8146 numMergedOcc 0
7 mol 9 unq 2 iso 1 dist 8.64915 10.5747 7.32257 13.1204 6.17406 4.86982 4.98827 7.35972 8.50424 10.8146 numMergedOcc 0
8 mol 9 unq 3 iso 0 dist 7.32257 10.5747 8.64915 5.72062 7.2707 12.3746 8.50424 7.35972 4.98827 12.0297 numMergedOcc 0
9 mol 9 unq 3 iso 1 dist 8.64915 10.5747 7.32257 12.3746 7.2707 5.72062 4.98827 7.35972 8.50424 12.0297 numMergedOcc 0
10 mol 9 unq 2 iso 0 dist 6.55811 5.06358 8.64915 9.10873 6.17406 13.1204 6.02809 7.35972 4.98827 10.8146 numMergedOcc 0
11 mol 9 unq 2 iso 1 dist 8.64915 5.06358 6.55811 13.1204 6.17406 9.10873 4.98827 7.35972 6.02809 10.8146 numMergedOcc 0
12 mol 9 unq 3 iso 0 dist 6.55811 5.06358 8.64915 7.6565 7.2707 12.3746 6.02809 7.35972 4.98827 12.0297 numMergedOcc 0
13 mol 9 unq 3 iso 1 dist 8.64915 5.06358 6.55811 12.3746 7.2707 7.6565 4.98827 7.35972 6.02809 12.0297 numMergedOcc 0
14 mol 9 unq 4 iso 0 dist 7.36018 5.06358 8.17347 7.6565 8.99816 12.3746 6.02809 9.93542 4.98827 12.0297 numMergedOcc 0
15 mol 9 unq 4 iso 1 dist 8.17347 5.06358 7.36018 12.3746 8.99816 7.6565 4.98827 9.93542 6.02809 12.0297 numMergedOcc 0
16 mol 15 unq 0 iso 0 dist 5.89412 11.0528 7.07399 14.8121 9.41935 5.88545 9.75966 6.03257 4.39605 6.25997 numMergedOcc 0
17 mol 15 unq 0 iso 1 dist 7.07399 11.0528 5.89412 5.88545 9.41935 14.8121 4.39605 6.03257 9.75966 6.25997 numMergedOcc 0
18 mol 20 unq 0 iso 0 dist 7.51452 16.5895 9.20198 10.0614 6.70097 11.637 10.0815 5.86181 8.96335 10.3521 numMergedOcc 0
19 mol 20 unq 0 iso 1 dist 9.20198 16.5895 7.51452 11.637 6.70097 10.0614 8.96335 5.86181 10.0815 10.3521 numMergedOcc 0
20 mol 20 unq 1 iso 0 dist 7.51452 16.5895 9.20198 10.0614 6.70097 11.637 13.457 6.3253 6.05944 8.19819 numMergedOcc 0
21 mol 20 unq 1 iso 1 dist 9.20198 16.5895 7.51452 11.637 6.70097 10.0614 6.05944 6.3253 13.457 8.19819 numMergedOcc 0
22 mol 20 unq 2 iso 0 dist 7.51452 16.5895 9.20198 10.0614 6.70097 11.637 11.3821 5.80568 7.46656 6.11738 numMergedOcc 0
23 mol 20 unq 2 iso 1 dist 9.20198 16.5895 7.51452 11.637 6.70097 10.0614 7.46656 5.80568 11.3821 6.11738 numMergedOcc 0
24 mol 24 unq 0 iso 0 dist 8.4051 15.5315 7.29868 13.2525 6.23824 4.99125 12.176 6.72323 6.66749 6.39466 numMergedOcc 0
25 mol 24 unq 0 iso 1 dist 7.29868 15.5315 8.4051 4.99125 6.23824 13.2525 6.66749 6.72323 12.176 6.39466 numMergedOcc 0
26 mol 24 unq 1 iso 0 dist 8.4051 14.6259 8.60554 13.2525 6.23824 11.4659 12.176 6.72323 14.012 6.39466 numMergedOcc 0
27 mol 24 unq 1 iso 1 dist 8.60554 14.6259 8.4051 11.4659 6.23824 13.2525 14.012 6.72323 12.176 6.39466 numMergedOcc 0
28 mol 24 unq 1 iso 0 dist 7.29868 10.0952 8.60554 4.99125 6.23824 11.4659 6.66749 6.72323 14.012 6.39466 numMergedOcc 0
29 mol 24 unq 1 iso 1 dist 8.60554 10.0952 7.29868 11.4659 6.23824 4.99125 14.012 6.72323 6.66749 6.39466 numMergedOcc 0
30 mol 65 unq 0 iso 0 dist 6.72639 5.48814 6.76508 6.58414 8.76172 4.92177 5.51708 5.94206 6.47381 4.50437 numMergedOcc 0
31 mol 65 unq 0 iso 1 dist 6.76508 5.48814 6.72639 4.92177 8.76172 6.58414 6.47381 5.94206 5.51708 4.50437 numMergedOcc 0
32 mol 98 unq 0 iso 0 dist 5.78706 7.51619 7.23884 11.4024 6.90706 8.43357 11.3905 7.14031 14.2646 10.1557 numMergedOcc 0
33 mol 98 unq 0 iso 1 dist 7.23884 7.51619 5.78706 8.43357 6.90706 11.4024 14.2646 7.14031 11.3905 10.1557 numMergedOcc 0
34 mol 98 unq 1 iso 0 dist 5.78706 10.6225 5.59328 11.4024 6.90706 5.68803 11.3905 7.14031 4.67519 10.1557 numMergedOcc 0
35 mol 98 unq 1 iso 1 dist 5.59328 10.6225 5.78706 5.68803 6.90706 11.4024 4.67519 7.14031 11.3905 10.1557 numMergedOcc 0
36 mol 98 unq 2 iso 0 dist 5.78706 12.7411 7.5242 11.4024 6.90706 5.68885 11.3905 7.14031 10.4027 10.1557 numMergedOcc 0
37 mol 98 unq 2 iso 1 dist 7.5242 12.7411 5.78706 5.68885 6.90706 11.4024 10.4027 7.14031 11.3905 10.1557 numMergedOcc 0
38 mol 98 unq 1 iso 0 dist 7.23884 11.4338 5.59328 8.43357 6.90706 5.68803 14.2646 7.14031 4.67519 10.1557 numMergedOcc 0
39 mol 98 unq 1 iso 1 dist 5.59328 11.4338 7.23884 5.68803 6.90706 8.43357 4.67519 7.14031 14.2646 10.1557 numMergedOcc 0
40 mol 98 unq 2 iso 0 dist 7.23884 9.30161 7.5242 8.43357 6.90706 5.68885 14.2646 7.14031 10.4027 10.1557 numMergedOcc 0
41 mol 98 unq 2 iso 1 dist 7.5242 9.30161 7.23884 5.68885 6.90706 8.43357 10.4027 7.14031 14.2646 10.1557 numMergedOcc 0
42 mol 98 unq 2 iso 0 dist 5.59328 7.72877 7.5242 5.68803 6.90706 5.68885 4.67519 7.14031 10.4027 10.1557 numMergedOcc 0
43 mol 98 unq 2 iso 1 dist 7.5242 7.72877 5.59328 5.68885 6.90706 5.68803 10.4027 7.14031 4.67519 10.1557 numMergedOcc 0
44 mol 100 unq 0 iso 0 dist 7.01812 5.88134 8.30845 8.07089 6.84692 12.8256 10.6848 9.5057 15.3454 4.71426 numMergedOcc 0
45 mol 100 unq 0 iso 1 dist 8.30845 5.88134 7.01812 12.8256 6.84692 8.07089 15.3454 9.5057 10.6848 4.71426 numMergedOcc 0
46 mol 133 unq 0 iso 0 dist 6.16242 7.81217 5.87634 5.47259 6.49688 4.70102 12.131 8.95662 14.8102 14.6184 numMergedOcc 0
47 mol 133 unq 0 iso 1 dist 5.87634 7.81217 6.16242 4.70102 6.49688 5.47259 14.8102 8.95662 12.131 14.6184 numMergedOcc 0
48 mol 235 unq 0 iso 0 dist 6.36341 8.31875 6.21292 9.82715 5.3481 6.55862 5.5163 6.94789 7.77516 11.5344 numMergedOcc 0
49 mol 235 unq 0 iso 1 dist 6.21292 8.31875 6.36341 6.55862 5.3481 9.82715 7.77516 6.94789 5.5163 11.5344 numMergedOcc 0
50 mol 235 unq 1 iso 0 dist 6.36341 10.5547 9.21736 9.82715 5.3481 6.8239 5.5163 6.94789 11.7254 11.5344 numMergedOcc 0
51 mol 235 unq 1 iso 1 dist 9.21736 10.5547 6.36341 6.8239 5.3481 9.82715 11.7254 6.94789 5.5163 11.5344 numMergedOcc 0
52 mol 235 unq 1 iso 0 dist 6.21292 4.53064 9.21736 6.55862 5.3481 6.8239 7.77516 6.94789 11.7254 11.5344 numMergedOcc 0
53 mol 235 unq 1 iso 1 dist 9.21736 4.53064 6.21292 6.8239 5.3481 6.55862 11.7254 6.94789 7.77516 11.5344 numMergedOcc 0
54 mol 249 unq 0 iso 0 dist 5.48118 5.3927 7.25858 6.66935 5.72442 5.78976 9.0676 5.9627 6.56117 4.9236 numMergedOcc 0
55 mol 249 unq 0 iso 1 dist 7.25858 5.3927 5.48118 5.78976 5.72442 6.66935 6.56117 5.9627 9.0676 4.9236 numMergedOcc 0
56 mol 273 unq 0 iso 0 dist 8.83865 5.96724 9.18157 9.75887 6.83684 7.29345 12.0136 7.16346 12.1851 5.91142 numMergedOcc 0
57 mol 273 unq 0 iso 1 dist 9.18157 5.96724 8.83865 7.29345 6.83684 9.75887 12.1851 7.16346 12.0136 5.91142 numMergedOcc 0
58 mol 274 unq 0 iso 0 dist 7.46394 10.501 9.45514 10.0578 7.1364 10.0247 11.1602 7.75216 6.52035 4.45928 numMergedOcc 0
59 mol 274 unq 0 iso 1 dist 9.45514 10.501 7.46394 10.0247 7.1364 10.0578 6.52035 7.75216 11.1602 4.45928 numMergedOcc 0
60 mol 274 unq 1 iso 0 dist 7.46394 14.3919 8.91672 10.0578 7.1364 5.25703 11.1602 7.75216 5.58338 4.45928 numMergedOcc 0
61 mol 274 unq 1 iso 1 dist 8.91672 14.3919 7.46394 5.25703 7.1364 10.0578 5.58338 7.75216 11.1602 4.45928 numMergedOcc 0
62 mol 274 unq 2 iso 0 dist 7.46394 6.15918 7.1729 10.0578 7.1364 5.56942 11.1602 7.75216 5.71192 4.45928 numMergedOcc 0
63 mol 274 unq 2 iso 1 dist 7.1729 6.15918 7.46394 5.56942 7.1364 10.0578 5.71192 7.75216 11.1602 4.45928 numMergedOcc 0
64 mol 274 unq 1 iso 0 dist 9.45514 11.7196 8.91672 10.0247 7.1364 5.25703 6.52035 7.75216 5.58338 4.45928 numMergedOcc 0
65 mol 274 unq 1 iso 1 dist 8.91672 11.7196 9.45514 5.25703 7.1364 10.0247 5.58338 7.75216 6.52035 4.45928 numMergedOcc 0
66 mol 274 unq 2 iso 0 dist 9.45514 6.828 7.1729 10.0247 7.1364 5.56942 6.52035 7.75216 5.71192 4.45928 numMergedOcc 0
67 mol 274 unq 2 iso 1 dist 7.1729 6.828 9.45514 5.56942 7.1364 10.0247 5.71192 7.75216 6.52035 4.45928 numMergedOcc 0
68 mol 274 unq 2 iso 0 dist 8.91672 10.0083 7.1729 5.25703 7.1364 5.56942 5.58338 7.75216 5.71192 4.45928 numMergedOcc 0
69 mol 274 unq 2 iso 1 dist 7.1729 10.0083 8.91672 5.56942 7.1364 5.25703 5.71192 7.75216 5.58338 4.45928 numMergedOcc 0
70 mol 274 unq 3 iso 0 dist 8.52587 11.3308 6.39866 5.87456 5.0002 6.38211 6.20558 6.88827 6.16703 4.67674 numMergedOcc 0
71 mol 274 unq 3 iso 1 dist 6.39866 11.3308 8.52587 6.38211 5.0002 5.87456 6.16703 6.88827 6.20558 4.67674 numMergedOcc 0
72 mol 274 unq 4 iso 0 dist 8.52587 11.3308 6.39866 5.87456 5.0002 6.38211 16.3619 9.16942 5.64601 11.1431 numMergedOcc 0
73 mol 274 unq 4 iso 1 dist 6.39866 11.3308 8.52587 6.38211 5.0002 5.87456 5.64601 9.16942 16.3619 11.1431 numMergedOcc 0
