0 mol 20 unq 0 iso 0 dist 9.44151 6.81416 6.38533 6.98731 14.0449 8.72023 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.40392 8.15652 4.33963 8.23069 5.54419 4.93188 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 7.40392 8.15652 4.33963 8.59466 7.36323 9.24958 numMergedOcc 0
3 mol 70 unq 0 iso 0 dist 6.77833 4.67358 9.03317 9.17087 10.1773 9.31969 numMergedOcc 0
4 mol 70 unq 1 iso 0 dist 6.77833 4.67358 9.03317 5.33532 9.65964 6.54023 numMergedOcc 0
5 mol 70 unq 2 iso 0 dist 8.30653 9.33262 14.4239 9.9009 17.8699 9.31969 numMergedOcc 0
6 mol 70 unq 3 iso 0 dist 8.30653 9.33262 14.4239 9.66495 16.1199 6.54023 numMergedOcc 0
7 mol 70 unq 4 iso 0 dist 6.91739 9.33262 10.4473 9.9009 15.2906 9.31969 numMergedOcc 0
8 mol 70 unq 5 iso 0 dist 6.91739 9.33262 10.4473 9.66495 14.3002 6.54023 numMergedOcc 0
9 mol 94 unq 0 iso 0 dist 6.31237 7.63006 5.60279 10.119 10.1664 8.16733 numMergedOcc 0
10 mol 94 unq 1 iso 0 dist 6.31237 7.63006 5.60279 6.26149 7.89459 9.97569 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 9.26438 9.9387 15.9335 10.4339 15.7525 8.67766 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 9.26438 9.9387 15.9335 4.91393 13.1098 8.0831 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 8.86938 5.9819 8.56707 4.9102 7.71338 6.43433 numMergedOcc 0
14 mol 112 unq 1 iso 0 dist 8.86938 5.9819 8.56707 6.84034 12.603 9.92283 numMergedOcc 0
15 mol 112 unq 2 iso 0 dist 7.42474 5.9819 12.6695 4.9102 11.8312 6.43433 numMergedOcc 0
16 mol 112 unq 3 iso 0 dist 7.42474 5.9819 12.6695 6.84034 11.438 9.92283 numMergedOcc 0
17 mol 124 unq 0 iso 0 dist 6.71293 5.93793 9.70339 8.07661 14.4958 8.97264 numMergedOcc 0
18 mol 124 unq 1 iso 0 dist 6.71293 5.93793 9.70339 8.29712 14.8242 8.80896 numMergedOcc 0
19 mol 133 unq 0 iso 0 dist 8.66715 8.37793 8.28698 13.2145 13.268 6.76699 numMergedOcc 0
20 mol 133 unq 1 iso 0 dist 9.00172 8.37793 5.74088 13.2145 6.29155 6.76699 numMergedOcc 0
21 mol 134 unq 0 iso 0 dist 8.31276 5.8367 11.7434 11.9678 13.9286 7.36779 numMergedOcc 0
22 mol 134 unq 1 iso 0 dist 8.31276 5.8367 11.7434 13.0109 15.281 8.20836 numMergedOcc 0
23 mol 134 unq 2 iso 0 dist 5.79157 5.8367 5.12325 11.9678 11.3835 7.36779 numMergedOcc 0
24 mol 134 unq 3 iso 0 dist 5.79157 5.8367 5.12325 13.0109 9.86662 8.20836 numMergedOcc 0
25 mol 134 unq 4 iso 0 dist 5.50687 5.8367 6.02179 11.9678 12.9594 7.36779 numMergedOcc 0
26 mol 134 unq 5 iso 0 dist 5.50687 5.8367 6.02179 13.0109 14.0375 8.20836 numMergedOcc 0
27 mol 134 unq 6 iso 0 dist 7.30919 5.8367 10.9332 11.9678 18.1911 7.36779 numMergedOcc 0
28 mol 134 unq 7 iso 0 dist 7.30919 5.8367 10.9332 13.0109 17.9288 8.20836 numMergedOcc 0
29 mol 186 unq 0 iso 0 dist 9.52413 6.59729 10.3944 10.2733 16.6323 6.72641 numMergedOcc 0
30 mol 188 unq 0 iso 0 dist 8.67271 5.36962 4.46081 6.184 9.96154 8.47347 numMergedOcc 0
31 mol 189 unq 0 iso 0 dist 8.59972 9.5853 5.4905 5.56399 10.4329 8.56355 numMergedOcc 0
32 mol 209 unq 0 iso 0 dist 5.92907 6.43914 4.90038 5.35615 7.56373 8.41195 numMergedOcc 0
33 mol 230 unq 0 iso 0 dist 6.03738 6.47064 10.753 10.7614 16.2199 9.09271 numMergedOcc 0
34 mol 230 unq 1 iso 0 dist 6.03738 6.47064 10.753 11.777 17.3341 7.44838 numMergedOcc 0
35 mol 236 unq 0 iso 0 dist 8.95071 9.33359 7.00028 12.8358 6.27581 8.50331 numMergedOcc 0
36 mol 248 unq 0 iso 0 dist 7.40475 9.08064 5.99459 7.63032 7.69895 6.17052 numMergedOcc 0
37 mol 248 unq 1 iso 0 dist 7.40475 9.08064 5.99459 6.42334 7.21521 9.77666 numMergedOcc 0
38 mol 252 unq 0 iso 0 dist 6.17985 8.62351 5.89666 6.79111 8.1148 8.47784 numMergedOcc 0
39 mol 252 unq 1 iso 0 dist 6.17985 8.62351 5.89666 14.2609 14.2744 8.66469 numMergedOcc 0
40 mol 252 unq 2 iso 0 dist 7.91348 9.45457 8.24423 9.00146 12.6348 6.86945 numMergedOcc 0
41 mol 258 unq 0 iso 0 dist 9.2067 8.43941 5.27959 9.88911 6.42289 9.53063 numMergedOcc 0
42 mol 258 unq 1 iso 0 dist 9.16078 8.43941 8.25921 9.88911 10.1675 9.53063 numMergedOcc 0
43 mol 261 unq 0 iso 0 dist 9.80409 5.67349 6.04016 4.63237 9.14619 5.26434 numMergedOcc 0
44 mol 261 unq 1 iso 0 dist 9.80409 5.67349 6.04016 6.39263 8.45658 8.60026 numMergedOcc 0
45 mol 264 unq 0 iso 0 dist 9.07206 9.91954 12.6928 15.213 18.4752 7.52281 numMergedOcc 0
46 mol 264 unq 1 iso 0 dist 9.07206 9.91954 12.6928 7.50444 10.6405 6.42588 numMergedOcc 0
47 mol 294 unq 0 iso 0 dist 7.77765 5.78275 12.0308 9.13951 14.9913 7.91611 numMergedOcc 0
