0 mol 2 unq 0 iso 0 dist 9.79578 6.35824 5.74846 12.9527 7.16799 7.2721 numMergedOcc 0
1 mol 20 unq 0 iso 0 dist 9.88827 13.4715 9.38691 17.3543 8.92942 7.47395 numMergedOcc 0
2 mol 20 unq 1 iso 0 dist 6.30355 13.4715 8.65986 17.3543 11.253 7.47395 numMergedOcc 0
3 mol 20 unq 2 iso 0 dist 6.02975 13.4715 9.74724 17.3543 12.4229 7.47395 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 6.03041 11.1055 7.18124 5.11382 7.19357 8.25818 numMergedOcc 0
5 mol 28 unq 0 iso 0 dist 7.64064 5.44908 7.49391 8.06843 4.23443 9.74532 numMergedOcc 0
6 mol 28 unq 1 iso 0 dist 8.52826 10.9344 8.47637 18.3969 13.6544 8.53424 numMergedOcc 0
7 mol 28 unq 2 iso 0 dist 8.52826 10.9344 8.47637 15.4395 11.0902 7.08766 numMergedOcc 0
8 mol 28 unq 3 iso 0 dist 8.52826 10.9344 8.47637 13.5663 8.59089 4.82199 numMergedOcc 0
9 mol 63 unq 0 iso 0 dist 8.38463 6.40052 7.73753 11.8965 5.98039 8.14512 numMergedOcc 0
10 mol 63 unq 1 iso 0 dist 7.04533 9.53308 8.90965 10.8302 6.2569 7.23828 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 9.09944 10.9616 9.43682 11.1713 3.47821 7.84207 numMergedOcc 0
12 mol 120 unq 1 iso 0 dist 9.09944 10.9616 9.43682 12.1987 6.10769 6.98791 numMergedOcc 0
13 mol 120 unq 2 iso 0 dist 9.09944 5.53373 8.0564 11.1713 3.47821 8.56947 numMergedOcc 0
14 mol 120 unq 3 iso 0 dist 6.05523 8.24077 9.43682 5.56598 3.47821 7.84207 numMergedOcc 0
15 mol 120 unq 4 iso 0 dist 6.05523 8.24077 9.43682 9.65403 6.10769 6.98791 numMergedOcc 0
16 mol 120 unq 5 iso 0 dist 6.05523 3.79384 8.0564 5.56598 3.47821 8.56947 numMergedOcc 0
17 mol 120 unq 6 iso 0 dist 7.81657 5.56137 9.43682 5.39792 3.47821 7.84207 numMergedOcc 0
18 mol 120 unq 7 iso 0 dist 7.81657 5.56137 9.43682 8.44206 6.10769 6.98791 numMergedOcc 0
19 mol 120 unq 8 iso 0 dist 7.81657 6.80121 8.0564 5.39792 3.47821 8.56947 numMergedOcc 0
20 mol 123 unq 0 iso 0 dist 9.35857 7.17192 8.20345 10.4265 3.21474 8.78115 numMergedOcc 0
21 mol 123 unq 1 iso 0 dist 9.35857 11.592 5.38148 16.8162 8.56894 5.56127 numMergedOcc 0
22 mol 123 unq 2 iso 0 dist 9.35857 11.592 5.38148 10.4265 3.21474 8.03692 numMergedOcc 0
23 mol 123 unq 3 iso 0 dist 9.35857 11.592 5.38148 13.5724 9.94939 5.36214 numMergedOcc 0
24 mol 123 unq 4 iso 0 dist 9.93886 3.50983 8.20345 9.72421 3.21474 8.78115 numMergedOcc 0
25 mol 123 unq 5 iso 0 dist 9.93886 11.8396 5.38148 16.4685 8.56894 5.56127 numMergedOcc 0
26 mol 123 unq 6 iso 0 dist 9.93886 11.8396 5.38148 9.72421 3.21474 8.03692 numMergedOcc 0
27 mol 123 unq 7 iso 0 dist 9.93886 11.8396 5.38148 15.2739 9.94939 5.36214 numMergedOcc 0
28 mol 123 unq 8 iso 0 dist 6.49558 5.85997 8.20345 8.35926 3.21474 8.78115 numMergedOcc 0
29 mol 123 unq 9 iso 0 dist 6.49558 3.61945 5.38148 8.09682 8.56894 5.56127 numMergedOcc 0
30 mol 123 unq 10 iso 0 dist 6.49558 3.61945 5.38148 8.35926 3.21474 8.03692 numMergedOcc 0
31 mol 123 unq 11 iso 0 dist 6.49558 3.61945 5.38148 7.41568 9.94939 5.36214 numMergedOcc 0
32 mol 141 unq 0 iso 0 dist 6.3093 5.71838 7.70581 9.6733 8.99049 5.60448 numMergedOcc 0
33 mol 141 unq 1 iso 0 dist 8.43607 10.616 7.70581 13.7236 8.99049 5.60448 numMergedOcc 0
34 mol 176 unq 0 iso 0 dist 9.33188 12.7977 5.58647 12.2762 5.64063 6.85902 numMergedOcc 0
35 mol 266 unq 0 iso 0 dist 8.89002 9.42852 8.53393 17.0673 13.7573 7.8598 numMergedOcc 0
36 mol 266 unq 1 iso 0 dist 8.89002 9.42852 8.53393 13.3819 10.0357 8.25286 numMergedOcc 0
37 mol 266 unq 2 iso 0 dist 8.89002 9.63536 7.24165 17.0673 13.7573 7.80711 numMergedOcc 0
38 mol 266 unq 3 iso 0 dist 8.89002 9.63536 7.24165 13.3819 10.0357 9.9965 numMergedOcc 0
