0 mol 0 unq 0 iso 0 dist 7.20999 13.6767 9.19007 4.21143 9.67081 16.5238 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 7.20999 10.6033 9.56794 4.21143 9.67081 11.9068 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 6.23095 6.06832 5.81959 5.24477 7.03372 6.32857 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.17086 8.33667 9.93832 6.1032 7.39848 6.59887 numMergedOcc 0
4 mol 52 unq 0 iso 0 dist 5.26018 11.8848 9.66501 5.02333 6.22221 7.92666 numMergedOcc 0
5 mol 52 unq 1 iso 0 dist 7.1203 8.65709 9.66501 10.0938 6.22221 7.92666 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 9.20523 7.80321 7.9814 14.6873 8.06267 9.21465 numMergedOcc 0
7 mol 68 unq 1 iso 0 dist 9.20523 7.80321 7.9814 11.7508 5.88334 6.22999 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.16299 11.9686 8.85586 11.3918 7.37171 12.6176 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 8.16299 11.4934 7.11 11.3918 7.37171 14.2305 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 8.27015 16.4476 8.85586 6.29235 7.37171 12.6176 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 8.27015 14.727 7.11 6.29235 7.37171 14.2305 numMergedOcc 0
12 mol 98 unq 0 iso 0 dist 8.05602 14.9908 7.26086 12.6133 7.92856 8.67903 numMergedOcc 0
13 mol 109 unq 0 iso 0 dist 9.45397 9.01694 7.55384 14.5521 9.63963 6.30703 numMergedOcc 0
14 mol 111 unq 0 iso 0 dist 9.04546 10.1874 7.71107 9.05868 9.06601 12.2445 numMergedOcc 0
15 mol 111 unq 1 iso 0 dist 9.04546 10.1874 7.71107 9.16288 5.98809 3.75797 numMergedOcc 0
16 mol 119 unq 0 iso 0 dist 7.85527 8.79034 6.98934 10.6622 7.60162 9.53672 numMergedOcc 0
17 mol 119 unq 1 iso 0 dist 7.85527 5.53632 7.99623 10.6622 7.60162 8.90156 numMergedOcc 0
18 mol 131 unq 0 iso 0 dist 8.99949 14.8405 9.29384 7.51072 8.80895 9.6795 numMergedOcc 0
19 mol 141 unq 0 iso 0 dist 7.34465 7.97183 6.69515 10.443 7.46621 10.7652 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 6.15806 6.37333 5.60393 8.62303 7.13783 12.0319 numMergedOcc 0
21 mol 210 unq 0 iso 0 dist 8.71409 3.99796 5.37446 10.8881 6.85824 7.61953 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 9.95045 16.7146 7.83711 15.2257 8.25985 6.20756 numMergedOcc 0
23 mol 232 unq 1 iso 0 dist 9.95045 16.7146 7.83711 11.1518 9.27788 11.7554 numMergedOcc 0
24 mol 240 unq 0 iso 0 dist 9.68888 17.2138 9.47583 9.19419 5.77749 10.2659 numMergedOcc 0
25 mol 253 unq 0 iso 0 dist 8.68368 14.7937 9.66465 15.6704 8.94786 3.15936 numMergedOcc 0
26 mol 253 unq 1 iso 0 dist 8.68368 14.7937 9.66465 13.5912 9.1927 5.26612 numMergedOcc 0
27 mol 253 unq 2 iso 0 dist 8.68368 14.7937 9.66465 3.99655 9.60694 13.8016 numMergedOcc 0
28 mol 253 unq 3 iso 0 dist 8.68368 14.7937 9.66465 5.37143 9.27311 16.4545 numMergedOcc 0
29 mol 274 unq 0 iso 0 dist 6.36173 6.35113 7.52109 12.2565 8.12739 8.96388 numMergedOcc 0
30 mol 274 unq 1 iso 0 dist 6.36173 6.35113 7.52109 10.2664 6.09853 6.75363 numMergedOcc 0
31 mol 274 unq 2 iso 0 dist 6.36173 5.54474 7.44083 12.2565 8.12739 12.596 numMergedOcc 0
32 mol 274 unq 3 iso 0 dist 6.36173 5.54474 7.44083 10.2664 6.09853 8.42538 numMergedOcc 0
33 mol 278 unq 0 iso 0 dist 7.58272 12.325 7.67245 9.89274 5.35705 5.78276 numMergedOcc 0
