0 mol 11 unq 0 iso 0 dist 9.23212 9.74528 9.68636 17.4352 13.8584 9.81983 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 5.36645 8.26877 6.88863 14.2257 11.8552 7.11491 numMergedOcc 0
2 mol 48 unq 1 iso 0 dist 8.89758 8.10222 8.42491 11.0408 12.2772 7.1829 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 8.62769 6.81735 6.91496 5.5226 11.7113 8.75957 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 9.05547 8.185 10.1462 15.4471 17.4172 9.38538 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 9.7754 5.26566 6.60361 7.41059 14.6844 9.87699 numMergedOcc 0
6 mol 79 unq 0 iso 0 dist 5.49623 7.75543 3.83059 12.0977 11.1154 8.84225 numMergedOcc 0
7 mol 79 unq 1 iso 0 dist 5.49623 7.75543 3.83059 8.15741 8.77598 6.72546 numMergedOcc 0
8 mol 92 unq 0 iso 0 dist 6.30103 6.34669 9.85862 11.6215 17.0782 8.43964 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 7.23052 8.50362 9.79481 10.1583 9.79969 8.65859 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 7.5984 5.33772 6.75249 8.28318 9.14266 7.2932 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 6.73365 8.06007 12.5746 10.3139 14.1487 4.51777 numMergedOcc 0
12 mol 175 unq 1 iso 0 dist 6.73365 8.06007 12.5746 7.04147 12.1542 4.9606 numMergedOcc 0
13 mol 175 unq 2 iso 0 dist 9.45659 8.06007 13.5565 10.3139 16.2084 4.51777 numMergedOcc 0
14 mol 175 unq 3 iso 0 dist 9.45659 8.06007 13.5565 7.04147 14.966 4.9606 numMergedOcc 0
15 mol 175 unq 4 iso 0 dist 9.44856 8.06007 9.03819 10.3139 12.5221 4.51777 numMergedOcc 0
16 mol 175 unq 5 iso 0 dist 9.44856 8.06007 9.03819 7.04147 12.4656 4.9606 numMergedOcc 0
17 mol 206 unq 0 iso 0 dist 7.10166 9.58346 3.56132 14.2366 7.75885 7.9416 numMergedOcc 0
18 mol 206 unq 1 iso 0 dist 9.66896 9.60549 3.56132 5.91675 7.75885 7.9416 numMergedOcc 0
19 mol 280 unq 0 iso 0 dist 8.40961 7.00616 4.51188 5.87081 9.76787 9.47429 numMergedOcc 0
20 mol 280 unq 1 iso 0 dist 9.42213 9.19653 4.51188 11.8683 9.76787 9.47429 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 8.08993 8.2236 14.4667 6.50962 14.5221 7.74874 numMergedOcc 0
22 mol 284 unq 1 iso 0 dist 7.34344 8.2236 12.4957 6.50962 6.78191 7.74874 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 7.45019 8.17436 12.3128 13.2009 16.8377 9.25759 numMergedOcc 0
24 mol 288 unq 0 iso 0 dist 7.45019 8.17436 12.3128 13.2009 16.8377 9.25759 numMergedOcc 0
25 mol 289 unq 0 iso 0 dist 7.45019 8.17436 12.3128 13.2009 16.8377 9.25759 numMergedOcc 0
