0 mol 1 unq 0 iso 0 dist 5.74199 8.69605 10.4572 9.78935 5.972 14.4278 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 8.99402 9.78153 17.1926 6.05338 5.30796 12.1866 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 9.26685 9.5937 5.4483 9.16861 5.91142 10.7882 numMergedOcc 0
3 mol 17 unq 1 iso 0 dist 9.26685 7.34681 9.4204 9.16861 5.91142 9.91874 numMergedOcc 0
4 mol 37 unq 0 iso 0 dist 9.25986 7.65802 9.16636 8.50293 10.3295 7.14868 numMergedOcc 0
5 mol 37 unq 1 iso 0 dist 9.25986 7.65802 9.16636 8.82649 4.68181 5.58769 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 7.38928 9.40644 8.74683 9.38206 4.17606 5.79865 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 7.38928 5.35252 5.03338 9.38206 4.17606 4.91651 numMergedOcc 0
8 mol 48 unq 2 iso 0 dist 8.36915 9.53081 13.2937 8.80334 10.7888 16.9756 numMergedOcc 0
9 mol 48 unq 3 iso 0 dist 6.01454 9.53081 5.41488 8.80334 13.7656 16.9756 numMergedOcc 0
10 mol 64 unq 0 iso 0 dist 9.3473 8.86433 12.8692 7.72437 5.41569 7.71161 numMergedOcc 0
11 mol 64 unq 1 iso 0 dist 6.08228 5.66803 5.88036 8.61926 7.41847 4.56868 numMergedOcc 0
12 mol 64 unq 2 iso 0 dist 7.24183 5.41357 7.05519 8.64746 5.78769 4.97497 numMergedOcc 0
13 mol 64 unq 3 iso 0 dist 7.24183 9.30042 8.49962 8.64746 5.78769 6.60091 numMergedOcc 0
14 mol 69 unq 0 iso 0 dist 8.36667 8.70964 11.5923 5.29487 9.46017 10.6503 numMergedOcc 0
15 mol 99 unq 0 iso 0 dist 6.81741 8.68674 4.74328 9.46619 5.17028 6.83905 numMergedOcc 0
16 mol 105 unq 0 iso 0 dist 8.80388 6.11833 5.89806 9.3724 11.2006 6.10266 numMergedOcc 0
17 mol 105 unq 1 iso 0 dist 7.28156 6.11833 6.96209 9.3724 10.9335 6.10266 numMergedOcc 0
18 mol 129 unq 0 iso 0 dist 8.34427 9.52061 7.12885 7.65371 10.164 13.0969 numMergedOcc 0
19 mol 160 unq 0 iso 0 dist 8.87648 8.1876 4.70871 9.50008 9.33636 8.48235 numMergedOcc 0
20 mol 165 unq 0 iso 0 dist 9.59989 6.85551 9.94274 8.4082 5.48376 10.9999 numMergedOcc 0
21 mol 167 unq 0 iso 0 dist 9.82329 7.20545 9.97915 9.72291 6.28495 10.4219 numMergedOcc 0
22 mol 171 unq 0 iso 0 dist 9.47945 6.19457 10.2353 7.13078 6.77761 3.96523 numMergedOcc 0
23 mol 183 unq 0 iso 0 dist 7.94469 8.84987 6.08215 8.57818 8.82097 13.8273 numMergedOcc 0
24 mol 189 unq 0 iso 0 dist 7.04604 6.77641 9.94485 4.96433 5.87044 5.88642 numMergedOcc 0
25 mol 189 unq 1 iso 0 dist 7.04604 7.54658 4.92169 4.96433 5.87044 4.8442 numMergedOcc 0
26 mol 220 unq 0 iso 0 dist 7.35148 6.39087 11.4142 9.13234 9.3304 7.56892 numMergedOcc 0
27 mol 220 unq 1 iso 0 dist 7.57712 5.25149 10.1832 5.00266 7.84277 4.51612 numMergedOcc 0
28 mol 220 unq 2 iso 0 dist 7.57712 8.6368 13.4455 5.00266 7.84277 8.8105 numMergedOcc 0
29 mol 220 unq 3 iso 0 dist 7.20255 5.25149 9.96224 5.00266 5.83946 4.51612 numMergedOcc 0
30 mol 220 unq 4 iso 0 dist 7.20255 8.6368 8.70221 5.00266 5.83946 8.8105 numMergedOcc 0
31 mol 220 unq 5 iso 0 dist 7.57716 6.50756 8.34243 9.49722 12.5157 7.8513 numMergedOcc 0
32 mol 220 unq 6 iso 0 dist 8.98362 6.50756 5.82963 9.49722 5.34316 7.8513 numMergedOcc 0
33 mol 224 unq 0 iso 0 dist 7.58998 6.23677 6.88745 8.76325 9.57742 4.76056 numMergedOcc 0
34 mol 226 unq 0 iso 0 dist 7.20862 8.74399 12.3908 7.45381 6.05562 12.3027 numMergedOcc 0
35 mol 236 unq 0 iso 0 dist 9.13126 4.71683 8.3795 5.77356 10.3827 4.71339 numMergedOcc 0
36 mol 236 unq 1 iso 0 dist 9.13126 4.71683 8.3795 9.24309 12.2148 11.3543 numMergedOcc 0
37 mol 239 unq 0 iso 0 dist 6.00654 9.01071 12.178 4.57548 5.28695 11.2678 numMergedOcc 0
38 mol 239 unq 1 iso 0 dist 6.00654 8.86185 8.20191 4.57548 5.28695 4.81796 numMergedOcc 0
39 mol 239 unq 2 iso 0 dist 8.34832 8.48545 14.2079 9.51945 15.8519 9.75577 numMergedOcc 0
40 mol 258 unq 0 iso 0 dist 8.97411 8.58092 13.2474 6.73928 5.28906 11.8838 numMergedOcc 0
41 mol 266 unq 0 iso 0 dist 8.61786 8.8646 9.94141 5.45375 4.75686 8.73313 numMergedOcc 0
42 mol 266 unq 1 iso 0 dist 8.61786 8.8646 9.94141 9.9145 10.8282 13.3737 numMergedOcc 0
43 mol 266 unq 2 iso 0 dist 8.42706 8.8646 3.93133 5.45375 10.3992 8.73313 numMergedOcc 0
44 mol 266 unq 3 iso 0 dist 8.42706 8.8646 3.93133 9.9145 15.5784 13.3737 numMergedOcc 0
45 mol 293 unq 0 iso 0 dist 8.8788 4.72125 8.14268 5.50284 7.15032 5.86908 numMergedOcc 0
46 mol 293 unq 1 iso 0 dist 8.8788 4.72125 8.14268 8.88355 4.91842 10.4612 numMergedOcc 0
