0 mol 13 unq 0 iso 0 dist 9.57675 8.46021 7.64861 6.67016 7.98679 8.70822 numMergedOcc 0
1 mol 13 unq 1 iso 0 dist 8.84159 9.99342 7.64861 14.442 7.98679 8.70822 numMergedOcc 0
2 mol 45 unq 0 iso 0 dist 7.97558 4.9892 5.2315 10.9773 9.32898 10.7333 numMergedOcc 0
3 mol 100 unq 0 iso 0 dist 9.95103 5.23 9.18792 6.04919 9.5669 7.82866 numMergedOcc 0
4 mol 108 unq 0 iso 0 dist 8.06774 4.68231 7.3542 3.73122 6.12967 6.05347 numMergedOcc 0
5 mol 114 unq 0 iso 0 dist 7.78223 4.87445 5.32751 10.8586 9.35942 11.064 numMergedOcc 0
6 mol 114 unq 1 iso 0 dist 7.78223 4.87445 5.32751 11.0397 7.42482 10.1476 numMergedOcc 0
7 mol 116 unq 0 iso 0 dist 6.63731 4.83147 9.28045 8.27695 8.79367 12.6546 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 7.35385 8.52311 9.03842 12.6656 6.73983 14.5524 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 7.35385 8.52311 9.03842 14.7644 8.6387 14.0071 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 9.57242 13.2955 9.54144 13.5919 9.79069 5.57459 numMergedOcc 0
11 mol 186 unq 0 iso 0 dist 9.53805 16.209 7.89312 8.99916 5.45675 8.54772 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 6.67239 9.44645 9.72906 8.14788 7.38566 6.77056 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 6.23146 9.44645 6.02641 8.14788 8.28466 6.77056 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 9.02661 14.6393 9.71673 16.9837 8.2997 13.5618 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 5.92532 3.87167 9.04531 8.7465 7.85414 10.4785 numMergedOcc 0
