0 mol 17 unq 0 iso 0 dist 6.76604 7.30541 6.48378 5.22923 9.88955 8.55161 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 9.97806 8.10063 9.46319 6.09311 14.6574 8.11143 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 9.97806 8.10063 9.46319 6.50899 12.2221 8.9776 numMergedOcc 0
3 mol 24 unq 2 iso 0 dist 6.32779 8.10063 6.22149 6.09311 9.74777 8.11143 numMergedOcc 0
4 mol 24 unq 3 iso 0 dist 6.32779 8.10063 6.22149 6.50899 10.872 8.9776 numMergedOcc 0
5 mol 24 unq 4 iso 0 dist 6.94728 8.88399 6.74888 3.94196 5.11382 5.65754 numMergedOcc 0
6 mol 37 unq 0 iso 0 dist 8.28713 6.48296 4.2096 6.96814 6.32052 4.07334 numMergedOcc 0
7 mol 53 unq 0 iso 0 dist 7.57267 9.26043 11.8682 5.86778 13.2731 9.52717 numMergedOcc 0
8 mol 61 unq 0 iso 0 dist 9.4196 9.12873 9.39417 3.30756 11.4147 7.93498 numMergedOcc 0
9 mol 61 unq 1 iso 0 dist 7.61513 9.12873 5.30715 3.30756 8.51839 7.93498 numMergedOcc 0
10 mol 63 unq 0 iso 0 dist 9.22609 7.10403 9.02438 11.1855 11.8965 7.85738 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 7.52742 6.27877 4.75717 3.81285 6.56288 7.51319 numMergedOcc 0
12 mol 85 unq 1 iso 0 dist 7.52742 6.27877 4.75717 6.17121 5.97559 8.49887 numMergedOcc 0
13 mol 91 unq 0 iso 0 dist 8.42914 8.01351 10.1359 9.46631 15.8707 8.91998 numMergedOcc 0
14 mol 91 unq 1 iso 0 dist 8.17327 8.01351 11.3866 9.46631 16.9889 8.91998 numMergedOcc 0
15 mol 91 unq 2 iso 0 dist 9.52936 8.01351 9.36488 9.46631 16.7772 8.91998 numMergedOcc 0
16 mol 93 unq 0 iso 0 dist 9.00874 6.67776 6.11046 3.27874 8.92653 5.23929 numMergedOcc 0
17 mol 104 unq 0 iso 0 dist 9.71834 7.15143 5.83615 4.07581 9.58427 9.43136 numMergedOcc 0
18 mol 141 unq 0 iso 0 dist 9.1717 5.68406 8.04699 6.8842 5.86693 9.57243 numMergedOcc 0
19 mol 141 unq 1 iso 0 dist 9.1717 5.68406 8.04699 6.46148 14.7271 8.12558 numMergedOcc 0
20 mol 141 unq 2 iso 0 dist 8.8319 9.46329 8.04699 5.05002 5.86693 9.57243 numMergedOcc 0
21 mol 141 unq 3 iso 0 dist 8.8319 9.46329 8.04699 12.4824 14.7271 8.12558 numMergedOcc 0
22 mol 151 unq 0 iso 0 dist 8.1034 8.15628 6.50161 6.07474 12.1622 9.00461 numMergedOcc 0
23 mol 176 unq 0 iso 0 dist 6.21825 9.24242 5.34777 3.71345 4.67031 8.79752 numMergedOcc 0
24 mol 176 unq 1 iso 0 dist 6.21825 9.24242 5.34777 8.25138 8.98043 7.29985 numMergedOcc 0
25 mol 176 unq 2 iso 0 dist 6.21825 9.24242 5.34777 7.10617 6.8243 7.58281 numMergedOcc 0
26 mol 176 unq 3 iso 0 dist 6.21825 9.24242 5.34777 10.5042 8.90797 8.8756 numMergedOcc 0
27 mol 176 unq 4 iso 0 dist 8.95504 9.24242 10.4177 3.71345 10.9465 8.79752 numMergedOcc 0
28 mol 176 unq 5 iso 0 dist 8.95504 9.24242 10.4177 8.25138 14.0725 7.29985 numMergedOcc 0
29 mol 176 unq 6 iso 0 dist 8.95504 9.24242 10.4177 7.10617 14.1409 7.58281 numMergedOcc 0
30 mol 176 unq 7 iso 0 dist 8.95504 9.24242 10.4177 10.5042 17.0236 8.8756 numMergedOcc 0
31 mol 204 unq 0 iso 0 dist 9.06541 6.97502 8.75176 3.88406 10.4409 9.26192 numMergedOcc 0
32 mol 233 unq 0 iso 0 dist 6.28379 5.79204 5.20211 5.74821 6.45095 6.33954 numMergedOcc 0
33 mol 233 unq 1 iso 0 dist 6.28379 6.50096 7.15553 6.41178 11.4404 8.2484 numMergedOcc 0
34 mol 233 unq 2 iso 0 dist 9.29279 6.50096 10.2283 6.41178 15.3608 8.2484 numMergedOcc 0
35 mol 233 unq 3 iso 0 dist 8.91643 5.79204 7.96328 5.74821 10.7337 6.33954 numMergedOcc 0
36 mol 233 unq 4 iso 0 dist 8.91643 9.91416 7.15553 9.33444 11.4404 8.2484 numMergedOcc 0
37 mol 233 unq 5 iso 0 dist 8.79848 9.91416 10.2283 9.33444 15.3608 8.2484 numMergedOcc 0
38 mol 294 unq 0 iso 0 dist 8.63523 9.23009 10.2133 10.0567 14.433 8.32582 numMergedOcc 0
