0 mol 25 unq 0 iso 0 dist 5.2296 4.44274 5.66008 7.1032 9.4714 4.38443 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 8.60575 7.5356 8.28079 5.06555 6.24688 3.52732 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 5.47819 4.78617 5.99879 3.82928 6.32539 4.42255 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 8.46957 10.4475 7.78572 13.1276 8.76341 11.9019 numMergedOcc 0
4 mol 154 unq 0 iso 0 dist 7.56048 4.35688 6.17381 5.528 9.33737 5.3455 numMergedOcc 0
5 mol 154 unq 1 iso 0 dist 7.56048 4.35688 6.17381 14.5117 8.32789 11.0858 numMergedOcc 0
6 mol 170 unq 0 iso 0 dist 5.13315 5.57652 6.3247 8.31883 7.45761 10.7924 numMergedOcc 0
7 mol 192 unq 0 iso 0 dist 5.91901 7.79406 8.27545 4.06707 5.90008 11.121 numMergedOcc 0
8 mol 213 unq 0 iso 0 dist 4.85533 4.34513 5.53162 11.8238 9.17692 8.28099 numMergedOcc 0
9 mol 239 unq 0 iso 0 dist 7.90944 6.23034 6.77267 10.8614 9.90442 9.87034 numMergedOcc 0
10 mol 279 unq 0 iso 0 dist 9.90251 17.9031 9.87771 17.5508 9.65535 6.21415 numMergedOcc 0
11 mol 279 unq 1 iso 0 dist 9.90251 17.9031 9.87771 15.0859 8.82519 3.79755 numMergedOcc 0
12 mol 279 unq 2 iso 0 dist 8.36667 8.0951 9.10723 12.1054 8.878 6.21415 numMergedOcc 0
