0 mol 26 unq 0 iso 0 dist 7.54282 5.34406 8.97754 9.61029 7.11305 7.98005 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 4.61355 4.38299 5.4713 8.2513 12.3186 9.45756 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 7.12529 5.94532 6.51117 11.8278 5.16401 9.94407 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 4.88863 7.39492 9.63906 6.6606 5.74372 8.06267 numMergedOcc 0
4 mol 68 unq 1 iso 0 dist 4.88863 4.89623 7.71872 6.6606 5.74372 5.88334 numMergedOcc 0
5 mol 68 unq 2 iso 0 dist 8.2282 12.5033 9.63906 13.3191 5.74372 8.06267 numMergedOcc 0
6 mol 68 unq 3 iso 0 dist 8.2282 11.778 7.71872 13.3191 5.74372 5.88334 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 6.22498 8.0664 9.14801 6.27528 5.10993 9.58351 numMergedOcc 0
8 mol 110 unq 0 iso 0 dist 8.27843 3.32173 9.25023 6.59361 8.4494 9.10911 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 7.79263 6.94754 4.55071 11.6835 6.30721 4.80684 numMergedOcc 0
10 mol 119 unq 1 iso 0 dist 7.79263 6.94754 4.55071 11.2945 10.5082 7.60162 numMergedOcc 0
11 mol 123 unq 0 iso 0 dist 8.18122 8.75597 4.14492 8.87148 4.1335 8.111 numMergedOcc 0
12 mol 123 unq 1 iso 0 dist 8.36221 7.36026 4.14492 11.8144 4.1335 8.111 numMergedOcc 0
13 mol 123 unq 2 iso 0 dist 8.6441 6.45068 4.14492 12.5647 4.1335 8.111 numMergedOcc 0
14 mol 123 unq 3 iso 0 dist 6.70684 6.36283 4.14492 9.26057 4.1335 8.111 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 8.32647 9.26049 7.25623 10.8079 4.08775 8.22001 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 9.43325 5.12831 9.4366 12.3862 11.6282 9.65093 numMergedOcc 0
17 mol 224 unq 0 iso 0 dist 8.14104 10.6033 7.99036 13.8077 6.03044 9.57465 numMergedOcc 0
18 mol 251 unq 0 iso 0 dist 6.96393 8.19568 7.72528 14.4322 11.5298 8.45764 numMergedOcc 0
