0 mol 11 unq 0 iso 0 dist 8.73067 4.79838 6.76736 7.5901 7.98326 9.81983 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 7.34031 8.44353 11.6319 12.8187 18.0984 7.20729 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 7.34031 4.74786 3.50984 8.13678 8.29857 5.7836 numMergedOcc 0
3 mol 48 unq 2 iso 0 dist 8.58829 7.08628 6.34854 13.0328 11.427 7.1829 numMergedOcc 0
4 mol 48 unq 3 iso 0 dist 7.281 4.53565 3.65036 8.24402 8.19993 5.82264 numMergedOcc 0
5 mol 48 unq 4 iso 0 dist 7.281 4.53565 3.65036 4.40229 11.427 8.56365 numMergedOcc 0
6 mol 48 unq 5 iso 0 dist 7.281 8.53722 11.611 12.7671 18.0801 7.32996 numMergedOcc 0
7 mol 48 unq 6 iso 0 dist 7.281 8.53722 11.611 4.40229 11.427 7.47783 numMergedOcc 0
8 mol 48 unq 7 iso 0 dist 7.281 6.15814 5.37655 4.40229 11.427 8.74151 numMergedOcc 0
9 mol 48 unq 8 iso 0 dist 7.281 7.70284 8.48119 4.40229 11.427 8.69662 numMergedOcc 0
10 mol 79 unq 0 iso 0 dist 9.63599 9.11491 5.84075 6.49291 9.78384 6.86517 numMergedOcc 0
11 mol 79 unq 1 iso 0 dist 9.63599 9.11491 5.84075 7.82761 4.93468 8.33791 numMergedOcc 0
12 mol 79 unq 2 iso 0 dist 5.9249 5.82384 4.31939 8.45612 9.62311 7.38548 numMergedOcc 0
13 mol 79 unq 3 iso 0 dist 7.87237 7.90338 5.25584 5.97134 9.26979 6.2576 numMergedOcc 0
14 mol 79 unq 4 iso 0 dist 7.87237 7.90338 5.25584 9.00783 9.05679 8.96069 numMergedOcc 0
15 mol 79 unq 5 iso 0 dist 7.87237 7.90338 5.25584 4.52595 4.93468 7.56495 numMergedOcc 0
16 mol 79 unq 6 iso 0 dist 7.87237 7.08462 5.79629 4.94373 9.62311 5.79139 numMergedOcc 0
17 mol 79 unq 7 iso 0 dist 7.87237 7.08462 5.79629 4.52595 4.93468 7.63923 numMergedOcc 0
18 mol 79 unq 8 iso 0 dist 8.01743 7.15907 5.41884 4.58851 4.93468 7.38548 numMergedOcc 0
19 mol 85 unq 0 iso 0 dist 6.05495 5.61151 5.22259 5.75469 11.5179 9.13593 numMergedOcc 0
20 mol 85 unq 1 iso 0 dist 6.05495 6.54289 7.66499 5.75469 11.5179 8.25144 numMergedOcc 0
21 mol 90 unq 0 iso 0 dist 9.56752 6.18681 5.57394 4.48233 11.5224 8.61893 numMergedOcc 0
22 mol 116 unq 0 iso 0 dist 6.49383 6.28029 4.13755 4.94926 8.38606 8.58308 numMergedOcc 0
23 mol 141 unq 0 iso 0 dist 4.25566 6.50336 3.80087 7.64948 9.83945 9.59109 numMergedOcc 0
24 mol 141 unq 1 iso 0 dist 7.31037 6.50336 3.80763 7.64948 6.75376 9.59109 numMergedOcc 0
25 mol 181 unq 0 iso 0 dist 7.13252 7.61421 13.4378 6.03415 12.1629 9.20617 numMergedOcc 0
26 mol 250 unq 0 iso 0 dist 5.97993 8.73744 4.14699 7.73342 9.70149 9.25035 numMergedOcc 0
27 mol 250 unq 1 iso 0 dist 6.44252 6.61917 4.14699 5.66455 9.70149 9.25035 numMergedOcc 0
28 mol 254 unq 0 iso 0 dist 8.94909 6.59989 11.9238 8.57314 16.4757 9.31434 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 9.20749 9.85661 6.97575 4.60275 9.16942 8.09181 numMergedOcc 0
30 mol 278 unq 0 iso 0 dist 7.48235 9.94661 14.4818 14.275 15.4692 9.9444 numMergedOcc 0
31 mol 278 unq 1 iso 0 dist 7.48235 9.94661 14.4818 11.3687 18.3232 8.1769 numMergedOcc 0
32 mol 287 unq 0 iso 0 dist 5.59555 5.50067 5.39801 5.13166 10.3435 8.58427 numMergedOcc 0
33 mol 288 unq 0 iso 0 dist 5.59555 5.50067 5.39801 5.13166 10.3435 8.58427 numMergedOcc 0
34 mol 289 unq 0 iso 0 dist 5.59555 5.50067 5.39801 5.13166 10.3435 8.58427 numMergedOcc 0
35 mol 294 unq 0 iso 0 dist 8.87606 6.25334 9.32087 11.177 17.7588 9.01437 numMergedOcc 0
