0 mol 8 unq 0 iso 0 dist 8.80278 8.73998 17.286 8.76702 9.60336 13.0138 numMergedOcc 0
1 mol 8 unq 0 iso 1 dist 8.73998 8.80278 17.286 8.76702 13.0138 9.60336 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 8.80278 8.73998 17.286 6.27477 13.4423 5.95251 numMergedOcc 0
3 mol 8 unq 1 iso 1 dist 8.73998 8.80278 17.286 6.27477 5.95251 13.4423 numMergedOcc 0
4 mol 22 unq 0 iso 0 dist 7.74523 6.90519 4.46853 8.28901 5.70422 4.69565 numMergedOcc 0
5 mol 22 unq 0 iso 1 dist 6.90519 7.74523 4.46853 8.28901 4.69565 5.70422 numMergedOcc 0
6 mol 59 unq 0 iso 0 dist 5.8166 6.47468 7.07517 8.97292 6.34748 13.0793 numMergedOcc 0
7 mol 59 unq 0 iso 1 dist 6.47468 5.8166 7.07517 8.97292 13.0793 6.34748 numMergedOcc 0
8 mol 59 unq 1 iso 0 dist 5.8166 6.47468 7.07517 6.85083 6.47721 8.64013 numMergedOcc 0
9 mol 59 unq 1 iso 1 dist 6.47468 5.8166 7.07517 6.85083 8.64013 6.47721 numMergedOcc 0
10 mol 64 unq 0 iso 0 dist 8.0009 8.91298 5.76037 8.93949 4.76091 6.13923 numMergedOcc 0
11 mol 64 unq 0 iso 1 dist 8.91298 8.0009 5.76037 8.93949 6.13923 4.76091 numMergedOcc 0
12 mol 86 unq 0 iso 0 dist 9.59708 7.18799 9.21866 7.26032 6.51657 5.19926 numMergedOcc 0
13 mol 86 unq 0 iso 1 dist 7.18799 9.59708 9.21866 7.26032 5.19926 6.51657 numMergedOcc 0
14 mol 103 unq 0 iso 0 dist 5.72494 8.70106 6.73664 5.94478 6.07628 10.2138 numMergedOcc 0
15 mol 103 unq 0 iso 1 dist 8.70106 5.72494 6.73664 5.94478 10.2138 6.07628 numMergedOcc 0
16 mol 148 unq 0 iso 0 dist 8.60157 6.72591 10.8037 9.7168 5.77745 12.9245 numMergedOcc 0
17 mol 148 unq 0 iso 1 dist 6.72591 8.60157 10.8037 9.7168 12.9245 5.77745 numMergedOcc 0
18 mol 148 unq 1 iso 0 dist 8.60157 6.72591 10.8037 7.38138 11.2162 10.5987 numMergedOcc 0
19 mol 148 unq 1 iso 1 dist 6.72591 8.60157 10.8037 7.38138 10.5987 11.2162 numMergedOcc 0
20 mol 150 unq 0 iso 0 dist 8.59359 6.80192 10.8647 9.61132 5.71213 12.8684 numMergedOcc 0
21 mol 150 unq 0 iso 1 dist 6.80192 8.59359 10.8647 9.61132 12.8684 5.71213 numMergedOcc 0
22 mol 150 unq 1 iso 0 dist 8.59359 6.80192 10.8647 7.34423 11.2566 10.4881 numMergedOcc 0
23 mol 150 unq 1 iso 1 dist 6.80192 8.59359 10.8647 7.34423 10.4881 11.2566 numMergedOcc 0
24 mol 182 unq 0 iso 0 dist 7.03216 9.42196 9.61687 6.31492 9.72559 13.9897 numMergedOcc 0
25 mol 182 unq 0 iso 1 dist 9.42196 7.03216 9.61687 6.31492 13.9897 9.72559 numMergedOcc 0
26 mol 189 unq 0 iso 0 dist 8.81184 9.71306 16.0744 9.58744 13.1061 11.7613 numMergedOcc 0
27 mol 189 unq 0 iso 1 dist 9.71306 8.81184 16.0744 9.58744 11.7613 13.1061 numMergedOcc 0
28 mol 189 unq 1 iso 0 dist 8.81184 9.20296 16.3255 9.58744 13.1061 6.36139 numMergedOcc 0
29 mol 189 unq 1 iso 1 dist 9.20296 8.81184 16.3255 9.58744 6.36139 13.1061 numMergedOcc 0
30 mol 189 unq 1 iso 0 dist 9.71306 9.20296 8.74557 9.58744 11.7613 6.36139 numMergedOcc 0
31 mol 189 unq 1 iso 1 dist 9.20296 9.71306 8.74557 9.58744 6.36139 11.7613 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 9.33299 9.49732 15.3608 6.49599 7.32419 11.0067 numMergedOcc 0
33 mol 259 unq 0 iso 1 dist 9.49732 9.33299 15.3608 6.49599 11.0067 7.32419 numMergedOcc 0
34 mol 259 unq 1 iso 0 dist 9.33299 9.49732 15.3608 9.34738 6.04412 11.569 numMergedOcc 0
35 mol 259 unq 1 iso 1 dist 9.49732 9.33299 15.3608 9.34738 11.569 6.04412 numMergedOcc 0
36 mol 259 unq 2 iso 0 dist 9.33299 9.49732 15.3608 9.47382 12.7868 6.18571 numMergedOcc 0
37 mol 259 unq 2 iso 1 dist 9.49732 9.33299 15.3608 9.47382 6.18571 12.7868 numMergedOcc 0
38 mol 261 unq 0 iso 0 dist 9.0643 7.4202 11.7171 7.26647 6.80146 12.9384 numMergedOcc 0
39 mol 261 unq 0 iso 1 dist 7.4202 9.0643 11.7171 7.26647 12.9384 6.80146 numMergedOcc 0
40 mol 261 unq 1 iso 0 dist 9.0643 7.4202 11.7171 7.7309 9.00992 11.479 numMergedOcc 0
41 mol 261 unq 1 iso 1 dist 7.4202 9.0643 11.7171 7.7309 11.479 9.00992 numMergedOcc 0
42 mol 282 unq 0 iso 0 dist 7.28238 7.3389 10.2887 7.70229 6.17747 13.1327 numMergedOcc 0
43 mol 282 unq 0 iso 1 dist 7.3389 7.28238 10.2887 7.70229 13.1327 6.17747 numMergedOcc 0
44 mol 282 unq 1 iso 0 dist 7.28238 7.3389 10.2887 7.90792 7.94567 11.2762 numMergedOcc 0
45 mol 282 unq 1 iso 1 dist 7.3389 7.28238 10.2887 7.90792 11.2762 7.94567 numMergedOcc 0
46 mol 283 unq 0 iso 0 dist 6.89455 8.821 10.0849 7.92491 6.41403 4.69801 numMergedOcc 0
47 mol 283 unq 0 iso 1 dist 8.821 6.89455 10.0849 7.92491 4.69801 6.41403 numMergedOcc 0
48 mol 283 unq 1 iso 0 dist 6.89455 9.82337 7.89565 7.92491 6.41403 13.1972 numMergedOcc 0
49 mol 283 unq 1 iso 1 dist 9.82337 6.89455 7.89565 7.92491 13.1972 6.41403 numMergedOcc 0
50 mol 283 unq 1 iso 0 dist 8.821 9.82337 16.7238 7.92491 4.69801 13.1972 numMergedOcc 0
51 mol 283 unq 1 iso 1 dist 9.82337 8.821 16.7238 7.92491 13.1972 4.69801 numMergedOcc 0
52 mol 293 unq 0 iso 0 dist 6.02106 8.27274 5.34794 8.90008 8.15525 9.35524 numMergedOcc 0
53 mol 293 unq 0 iso 1 dist 8.27274 6.02106 5.34794 8.90008 9.35524 8.15525 numMergedOcc 0
