0 mol 24 unq 0 iso 0 dist 5.65754 5.61248 7.7447 13.3476 13.3652 8.24948 numMergedOcc 0
1 mol 63 unq 0 iso 0 dist 6.89855 5.74753 8.78414 9.16658 8.45456 7.4515 numMergedOcc 0
2 mol 63 unq 1 iso 0 dist 6.89855 5.74753 8.78414 8.94047 3.4677 9.76551 numMergedOcc 0
3 mol 63 unq 2 iso 0 dist 7.85738 5.82517 8.78414 11.521 8.45456 7.4515 numMergedOcc 0
4 mol 63 unq 3 iso 0 dist 7.85738 5.82517 8.78414 10.3656 3.4677 9.76551 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 9.32525 12.2859 9.63906 12.5034 9.21465 9.45329 numMergedOcc 0
6 mol 68 unq 1 iso 0 dist 9.05444 12.2859 7.71872 12.5034 6.22999 9.45329 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 6.65972 5.21981 4.78333 6.07578 5.47798 8.04168 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 4.2253 5.21981 4.74254 6.07578 7.86805 8.04168 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 7.69755 4.93836 5.35861 11.572 6.74231 7.26995 numMergedOcc 0
10 mol 83 unq 1 iso 0 dist 9.64197 8.82563 5.35861 12.9767 6.74231 7.26995 numMergedOcc 0
11 mol 93 unq 0 iso 0 dist 8.55758 5.84807 6.67678 11.2713 12.5638 7.8435 numMergedOcc 0
12 mol 93 unq 1 iso 0 dist 7.44027 5.84807 7.24956 11.2713 12.4215 7.8435 numMergedOcc 0
13 mol 112 unq 0 iso 0 dist 9.64908 6.13615 5.92828 10.7806 4.25001 4.99604 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 9.99012 12.1494 6.60366 6.93136 5.42311 8.68663 numMergedOcc 0
15 mol 143 unq 1 iso 0 dist 5.33772 7.11802 6.60366 9.79469 5.42311 8.68663 numMergedOcc 0
16 mol 152 unq 0 iso 0 dist 8.09561 14.2685 8.60651 12.6456 4.78989 7.1069 numMergedOcc 0
17 mol 158 unq 0 iso 0 dist 9.27714 11.3047 6.77583 10.8063 6.02991 5.48379 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 4.79423 9.5548 8.92135 12.4674 9.28201 8.57801 numMergedOcc 0
19 mol 194 unq 0 iso 0 dist 7.56217 5.39223 4.45769 8.63008 7.82899 5.53324 numMergedOcc 0
20 mol 194 unq 1 iso 0 dist 9.81055 5.39223 5.89939 8.63008 10.0237 5.53324 numMergedOcc 0
21 mol 251 unq 0 iso 0 dist 8.15014 5.04918 7.72528 5.0953 10.3735 6.42747 numMergedOcc 0
22 mol 251 unq 1 iso 0 dist 6.06154 12.3351 7.72528 13.7883 10.3735 6.42747 numMergedOcc 0
23 mol 252 unq 0 iso 0 dist 9.09279 15.5357 9.81261 23.5431 19.1465 9.39658 numMergedOcc 0
24 mol 252 unq 1 iso 0 dist 9.09279 15.5357 9.81261 19.3339 14.8966 5.9974 numMergedOcc 0
25 mol 260 unq 0 iso 0 dist 6.90472 4.35925 9.73217 8.54084 4.05076 9.65775 numMergedOcc 0
26 mol 260 unq 1 iso 0 dist 6.90472 13.8859 7.49606 8.54084 4.05076 9.50634 numMergedOcc 0
27 mol 285 unq 0 iso 0 dist 4.95596 5.62841 4.27826 12.6515 8.03918 8.94601 numMergedOcc 0
28 mol 285 unq 1 iso 0 dist 6.3508 5.62841 5.82074 12.6515 11.1127 8.94601 numMergedOcc 0
