0 mol 11 unq 0 iso 0 dist 5.47299 12.9682 9.89425 11.9176 6.76736 6.859 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.61183 5.37421 7.7447 10.9641 9.63925 5.80953 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 6.70325 4.80254 8.97754 11.2685 12.5394 6.81793 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 5.68794 4.76075 7.34832 11.853 9.10687 8.96684 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 8.9964 6.64474 7.34832 13.337 9.10687 8.96684 numMergedOcc 0
5 mol 46 unq 0 iso 0 dist 7.44805 3.66253 5.4713 6.02472 3.57198 5.43693 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.50939 6.1999 5.45099 12.8377 3.94039 8.77077 numMergedOcc 0
7 mol 85 unq 0 iso 0 dist 8.67342 7.74857 4.29937 11.1537 5.22259 5.05893 numMergedOcc 0
8 mol 85 unq 1 iso 0 dist 8.67342 10.4876 3.65628 11.1537 5.22259 5.71866 numMergedOcc 0
9 mol 85 unq 2 iso 0 dist 8.60062 7.74857 5.37869 11.1537 7.66499 5.05893 numMergedOcc 0
10 mol 85 unq 3 iso 0 dist 8.60062 10.4876 4.05415 11.1537 7.66499 5.71866 numMergedOcc 0
11 mol 85 unq 4 iso 0 dist 5.73739 9.36582 4.29937 10.2791 5.22259 5.05893 numMergedOcc 0
12 mol 85 unq 5 iso 0 dist 5.73739 8.8983 3.65628 10.2791 5.22259 5.71866 numMergedOcc 0
13 mol 85 unq 6 iso 0 dist 5.16225 9.36582 5.37869 10.2791 7.66499 5.05893 numMergedOcc 0
14 mol 85 unq 7 iso 0 dist 5.16225 8.8983 4.05415 10.2791 7.66499 5.71866 numMergedOcc 0
15 mol 93 unq 0 iso 0 dist 8.24402 4.85981 6.67678 12.1369 5.64998 9.19977 numMergedOcc 0
16 mol 93 unq 1 iso 0 dist 8.24402 4.85981 6.67678 8.69945 4.34681 7.28831 numMergedOcc 0
17 mol 93 unq 2 iso 0 dist 8.24402 4.85981 6.67678 13.0511 9.11796 9.71411 numMergedOcc 0
18 mol 93 unq 3 iso 0 dist 9.44156 6.38065 7.24956 10.8116 4.76749 9.19977 numMergedOcc 0
19 mol 93 unq 4 iso 0 dist 9.44156 6.38065 7.24956 11.35 5.73248 7.28831 numMergedOcc 0
20 mol 93 unq 5 iso 0 dist 9.44156 6.38065 7.24956 8.77074 7.24672 9.71411 numMergedOcc 0
21 mol 93 unq 6 iso 0 dist 7.14241 4.85981 8.28591 12.1369 15.6931 9.19977 numMergedOcc 0
22 mol 93 unq 7 iso 0 dist 7.14241 4.85981 8.28591 8.69945 13.5809 7.28831 numMergedOcc 0
23 mol 93 unq 8 iso 0 dist 7.14241 4.85981 8.28591 13.0511 10.6039 9.71411 numMergedOcc 0
24 mol 131 unq 0 iso 0 dist 7.34765 9.35007 8.49847 9.75061 4.94367 7.75314 numMergedOcc 0
25 mol 171 unq 0 iso 0 dist 8.82481 5.35456 9.68512 10.2527 8.77204 7.47964 numMergedOcc 0
26 mol 193 unq 0 iso 0 dist 9.00084 6.90307 6.94187 10.4788 5.96435 8.15661 numMergedOcc 0
27 mol 193 unq 1 iso 0 dist 9.50113 7.03555 6.94187 9.16058 5.96435 8.15661 numMergedOcc 0
28 mol 205 unq 0 iso 0 dist 4.93303 3.73699 7.88986 9.37516 10.4367 8.31721 numMergedOcc 0
29 mol 205 unq 1 iso 0 dist 9.95859 3.73699 7.4185 9.37516 5.27881 8.31721 numMergedOcc 0
30 mol 260 unq 0 iso 0 dist 4.76164 4.58993 7.49606 10.1774 7.28821 9.31888 numMergedOcc 0
