0 mol 4 unq 0 iso 0 dist 5.71752 9.20677 4.47629 4.4368 7.09907 9.0984 numMergedOcc 0
1 mol 30 unq 0 iso 0 dist 5.9581 8.15347 5.09775 5.06613 7.2159 5.80534 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 6.37408 7.51631 5.37935 9.04231 6.88786 5.57551 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 8.27446 9.73501 8.0072 16.8343 9.10386 10.869 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 8.79798 4.96173 7.41773 8.99211 6.59382 6.04223 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 6.17537 8.37507 10.2236 3.97579 5.57712 8.14427 numMergedOcc 0
6 mol 92 unq 2 iso 0 dist 8.11757 9.17505 9.47078 6.69503 6.78043 13.1026 numMergedOcc 0
7 mol 92 unq 3 iso 0 dist 8.11757 9.17505 9.47078 7.80674 5.74364 10.9904 numMergedOcc 0
8 mol 92 unq 4 iso 0 dist 9.4667 9.17505 5.48939 7.80674 8.60026 10.9904 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 8.63253 9.00369 8.94532 5.57291 8.07962 11.4052 numMergedOcc 0
10 mol 102 unq 1 iso 0 dist 8.63253 9.00369 8.94532 6.91222 7.58908 13.6759 numMergedOcc 0
11 mol 102 unq 2 iso 0 dist 5.15752 9.00369 6.94341 5.57291 9.54857 11.4052 numMergedOcc 0
12 mol 102 unq 3 iso 0 dist 5.15752 9.00369 6.94341 6.91222 9.32058 13.6759 numMergedOcc 0
13 mol 124 unq 0 iso 0 dist 8.25764 6.67979 8.5036 12.0836 7.83509 11.4564 numMergedOcc 0
14 mol 136 unq 0 iso 0 dist 7.43436 8.65282 4.91049 5.12719 9.87222 8.59512 numMergedOcc 0
15 mol 235 unq 0 iso 0 dist 5.47932 9.03149 4.61829 5.05894 6.71398 11.0565 numMergedOcc 0
16 mol 235 unq 1 iso 0 dist 6.82475 7.8548 13.1753 7.64186 8.88613 9.82099 numMergedOcc 0
17 mol 270 unq 0 iso 0 dist 8.0831 8.93961 12.9903 8.5694 6.72681 12.7835 numMergedOcc 0
18 mol 270 unq 1 iso 0 dist 8.0831 7.96508 3.53146 8.5694 6.72681 8.76202 numMergedOcc 0
19 mol 294 unq 0 iso 0 dist 9.91042 7.0445 9.78727 14.2497 8.82869 12.6729 numMergedOcc 0
