0 mol 21 unq 0 iso 0 dist 7.38586 7.3067 8.038 13.5547 6.93185 12.2721 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 8.10708 12.9966 5.45575 9.98108 9.43355 13.4649 numMergedOcc 0
2 mol 59 unq 1 iso 0 dist 8.10708 12.9966 5.45575 12.8035 7.9327 5.15625 numMergedOcc 0
3 mol 59 unq 2 iso 0 dist 8.42956 8.78405 5.45575 15.504 9.43355 13.4649 numMergedOcc 0
4 mol 59 unq 3 iso 0 dist 8.42956 8.78405 5.45575 4.9619 7.9327 5.15625 numMergedOcc 0
5 mol 59 unq 4 iso 0 dist 9.20253 12.0354 5.45575 15.8562 9.43355 13.4649 numMergedOcc 0
6 mol 59 unq 5 iso 0 dist 9.20253 12.0354 5.45575 10.3701 7.9327 5.15625 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 6.61636 8.08082 8.25207 10.745 6.51868 11.4461 numMergedOcc 0
8 mol 133 unq 1 iso 0 dist 6.61636 8.08082 8.25207 11.3682 7.34698 15.3902 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 9.84953 4.62682 5.90772 10.811 6.97487 6.48478 numMergedOcc 0
10 mol 155 unq 0 iso 0 dist 8.54318 5.2941 5.64806 11.765 9.0529 12.2591 numMergedOcc 0
11 mol 159 unq 0 iso 0 dist 9.2256 16.4839 9.53056 6.11852 6.72852 11.6094 numMergedOcc 0
12 mol 159 unq 1 iso 0 dist 9.2256 16.4839 9.53056 5.48097 8.52082 17.3643 numMergedOcc 0
13 mol 173 unq 0 iso 0 dist 7.33162 15.6753 9.25763 4.67407 8.41245 15.3501 numMergedOcc 0
14 mol 173 unq 1 iso 0 dist 7.33162 15.6753 9.25763 6.34062 6.64779 15.5823 numMergedOcc 0
15 mol 173 unq 2 iso 0 dist 7.33162 16.6412 9.63102 4.67407 8.41245 15.9805 numMergedOcc 0
16 mol 173 unq 3 iso 0 dist 7.33162 16.6412 9.63102 6.34062 6.64779 14.7982 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 9.47836 9.98274 9.69775 10.0092 9.52615 4.98219 numMergedOcc 0
18 mol 239 unq 0 iso 0 dist 4.57548 6.54029 5.73804 5.86546 7.02079 11.6736 numMergedOcc 0
19 mol 239 unq 1 iso 0 dist 4.57548 6.54029 5.73804 8.35939 5.88802 5.20078 numMergedOcc 0
20 mol 239 unq 2 iso 0 dist 8.02916 5.77898 7.40408 14.6713 8.08764 11.6003 numMergedOcc 0
21 mol 239 unq 3 iso 0 dist 8.02916 10.2178 6.77395 14.6713 8.08764 7.64962 numMergedOcc 0
22 mol 273 unq 0 iso 0 dist 6.59786 10.41 8.41674 7.10817 8.68913 5.62662 numMergedOcc 0
23 mol 273 unq 1 iso 0 dist 6.59786 4.62586 6.8391 7.10817 8.68913 5.06747 numMergedOcc 0
24 mol 273 unq 2 iso 0 dist 7.96519 4.62586 6.06557 4.30863 8.85779 6.30473 numMergedOcc 0
25 mol 282 unq 0 iso 0 dist 7.10557 8.36397 5.2527 5.61995 6.8972 8.03458 numMergedOcc 0
