0 mol 60 unq 0 iso 0 dist 8.4928 8.04272 4.82351 10.4126 6.46718 10.7867 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 9.16658 5.55574 12.5323 5.04771 4.92457 9.50826 numMergedOcc 0
2 mol 63 unq 1 iso 0 dist 8.94047 5.55574 9.63391 5.04771 8.18666 9.50826 numMergedOcc 0
3 mol 67 unq 0 iso 0 dist 6.0478 9.42982 5.89161 8.43533 9.87982 10.4773 numMergedOcc 0
4 mol 67 unq 1 iso 0 dist 6.0478 8.17929 12.4415 8.43533 9.87982 13.7596 numMergedOcc 0
5 mol 67 unq 2 iso 0 dist 6.0478 5.63802 10.8112 8.43533 9.87982 10.0501 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 6.07578 7.99438 10.3996 10.2068 8.51933 17.0474 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 6.07578 6.64915 11.2341 10.2068 8.51933 16.7741 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 5.22996 8.96747 12.0757 5.63423 7.7346 12.1774 numMergedOcc 0
9 mol 128 unq 0 iso 0 dist 7.50206 6.51968 8.06011 9.52999 7.12765 11.8543 numMergedOcc 0
10 mol 128 unq 1 iso 0 dist 7.50206 6.51968 8.06011 8.12622 6.28471 12.3001 numMergedOcc 0
11 mol 128 unq 2 iso 0 dist 7.50206 7.61237 5.19611 9.52999 7.12765 10.8446 numMergedOcc 0
12 mol 128 unq 3 iso 0 dist 7.50206 7.61237 5.19611 8.12622 6.28471 7.4442 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 6.85463 9.0087 3.76192 5.29862 5.97934 5.67088 numMergedOcc 0
14 mol 173 unq 0 iso 0 dist 4.0037 9.31172 11.4153 8.29493 9.02222 14.0859 numMergedOcc 0
15 mol 250 unq 0 iso 0 dist 9.48115 8.85979 14.352 5.66551 7.1454 11.9568 numMergedOcc 0
16 mol 282 unq 0 iso 0 dist 6.91282 7.84236 8.43801 12.5442 9.18236 16.8564 numMergedOcc 0
