0 mol 15 unq 0 iso 0 dist 9.05123 6.09263 6.82187 12.9688 4.96682 9.29358 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.85737 6.88453 8.0319 13.8202 9.97498 9.75144 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.84944 14.9082 8.03754 17.3158 10.1053 9.83618 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 7.21995 4.80528 8.03754 13.4284 10.1053 9.83618 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.8795 10.0338 8.44473 16.8472 10.8911 8.76003 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 8.52643 15.4665 8.75668 11.4891 4.97497 8.68586 numMergedOcc 0
6 mol 64 unq 1 iso 0 dist 8.52643 9.48441 9.64871 13.1196 10.2974 9.80142 numMergedOcc 0
7 mol 64 unq 2 iso 0 dist 8.52643 9.48441 9.64871 11.4891 4.97497 9.54144 numMergedOcc 0
8 mol 64 unq 3 iso 0 dist 5.41357 9.95527 8.75668 8.64746 4.97497 8.68586 numMergedOcc 0
9 mol 64 unq 4 iso 0 dist 5.41357 6.41829 9.64871 11.9614 10.2974 9.80142 numMergedOcc 0
10 mol 64 unq 5 iso 0 dist 5.41357 6.41829 9.64871 8.64746 4.97497 9.54144 numMergedOcc 0
11 mol 75 unq 0 iso 0 dist 8.25597 5.56574 9.20448 8.26819 8.88127 5.15851 numMergedOcc 0
12 mol 75 unq 1 iso 0 dist 4.76466 5.56574 6.96759 8.26819 6.78257 5.15851 numMergedOcc 0
13 mol 75 unq 2 iso 0 dist 8.67172 5.56574 6.97318 8.26819 4.7798 5.15851 numMergedOcc 0
14 mol 92 unq 0 iso 0 dist 8.15664 6.09495 7.11695 6.00131 6.85223 8.36431 numMergedOcc 0
15 mol 101 unq 0 iso 0 dist 7.1859 5.82598 9.65097 7.43143 4.09052 9.57816 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 9.33293 9.48465 7.9258 15.6542 10.8105 7.76729 numMergedOcc 0
17 mol 117 unq 0 iso 0 dist 7.79078 10.7092 9.32858 10.9336 5.13173 7.20326 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 8.8353 17.2988 9.47554 11.8194 6.61857 7.92688 numMergedOcc 0
19 mol 140 unq 0 iso 0 dist 8.94921 11.6044 8.67876 12.9329 6.57826 6.95323 numMergedOcc 0
20 mol 140 unq 1 iso 0 dist 8.94921 15.8205 9.11235 12.9329 6.57826 7.27371 numMergedOcc 0
21 mol 140 unq 2 iso 0 dist 7.77669 12.5321 8.67876 13.5695 6.57826 6.95323 numMergedOcc 0
22 mol 140 unq 3 iso 0 dist 7.77669 11.9489 9.11235 13.5695 6.57826 7.27371 numMergedOcc 0
23 mol 147 unq 0 iso 0 dist 5.32865 12.348 9.88662 14.8347 10.9183 8.33261 numMergedOcc 0
24 mol 152 unq 0 iso 0 dist 9.65031 14.069 8.41774 19.2222 10.8622 9.13561 numMergedOcc 0
25 mol 152 unq 1 iso 0 dist 8.51844 4.46956 8.41774 13.2468 10.8622 9.13561 numMergedOcc 0
26 mol 176 unq 0 iso 0 dist 7.98755 11.6341 8.02366 19.325 16.4277 8.61331 numMergedOcc 0
27 mol 187 unq 0 iso 0 dist 5.58167 4.98423 6.82787 7.9625 10.7843 9.27478 numMergedOcc 0
28 mol 195 unq 0 iso 0 dist 7.2833 5.34788 7.04524 10.0179 10.9358 8.36117 numMergedOcc 0
29 mol 195 unq 1 iso 0 dist 7.2833 5.34788 7.04524 10.0512 7.60158 6.77578 numMergedOcc 0
30 mol 204 unq 0 iso 0 dist 9.52029 18.5654 9.44947 20.3913 12.7783 5.90931 numMergedOcc 0
31 mol 220 unq 0 iso 0 dist 5.25149 6.19375 5.39218 12.6808 9.46015 6.84247 numMergedOcc 0
32 mol 220 unq 1 iso 0 dist 5.25149 6.19375 5.39218 5.00266 4.51612 6.99002 numMergedOcc 0
33 mol 224 unq 0 iso 0 dist 6.23677 6.87755 7.49783 8.76325 4.76056 7.06793 numMergedOcc 0
34 mol 224 unq 1 iso 0 dist 6.23677 6.87755 7.49783 12.0468 10.7068 6.67585 numMergedOcc 0
35 mol 224 unq 2 iso 0 dist 9.04741 12.3271 7.49783 12.4794 4.76056 7.06793 numMergedOcc 0
36 mol 224 unq 3 iso 0 dist 9.04741 12.3271 7.49783 17.0348 10.7068 6.67585 numMergedOcc 0
37 mol 224 unq 4 iso 0 dist 7.31608 11.0252 7.49783 8.85101 4.76056 7.06793 numMergedOcc 0
38 mol 224 unq 5 iso 0 dist 7.31608 11.0252 7.49783 13.64 10.7068 6.67585 numMergedOcc 0
39 mol 236 unq 0 iso 0 dist 4.71683 7.77821 7.87233 5.77356 4.71339 5.34718 numMergedOcc 0
40 mol 239 unq 0 iso 0 dist 8.46734 6.03322 6.43546 12.8792 10.9732 7.20082 numMergedOcc 0
41 mol 259 unq 0 iso 0 dist 9.86267 7.02254 6.11671 9.44826 3.83813 7.50578 numMergedOcc 0
42 mol 277 unq 0 iso 0 dist 6.66936 7.44724 4.81916 12.4404 6.20663 9.41725 numMergedOcc 0
43 mol 277 unq 1 iso 0 dist 8.15119 5.77904 4.81916 11.7564 6.20663 9.41725 numMergedOcc 0
44 mol 293 unq 0 iso 0 dist 4.72125 5.66805 5.44043 5.50284 5.86908 8.56847 numMergedOcc 0
45 mol 293 unq 1 iso 0 dist 7.41524 8.15525 5.44043 12.799 5.86908 8.56847 numMergedOcc 0
46 mol 293 unq 2 iso 0 dist 6.42608 9.35524 5.44043 10.0258 5.86908 8.56847 numMergedOcc 0
47 mol 293 unq 3 iso 0 dist 6.52889 9.51167 9.25564 7.44889 6.42397 8.56847 numMergedOcc 0
