0 mol 19 unq 0 iso 0 dist 6.79758 4.48525 9.79426 10.7501 9.27965 9.55978 numMergedOcc 0
1 mol 55 unq 0 iso 0 dist 8.77199 5.91098 9.30367 12.0406 6.97484 8.96223 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.52544 6.1691 7.02854 9.47924 8.50377 7.71596 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 8.60438 4.77259 6.6146 11.5456 6.3566 8.6308 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 9.26301 12.5962 5.31281 5.09285 7.22809 8.592 numMergedOcc 0
5 mol 173 unq 0 iso 0 dist 7.71773 9.41685 5.97008 15.1964 8.90271 7.13369 numMergedOcc 0
6 mol 203 unq 0 iso 0 dist 9.76204 5.50961 7.9591 10.2853 4.51654 8.8589 numMergedOcc 0
7 mol 211 unq 0 iso 0 dist 8.63677 14.0337 9.8921 17.461 15.2751 7.15386 numMergedOcc 0
8 mol 211 unq 1 iso 0 dist 8.63677 14.0337 9.8921 20.5225 17.5039 7.73993 numMergedOcc 0
9 mol 211 unq 2 iso 0 dist 8.63677 14.0337 9.8921 16.2008 16.4954 9.45365 numMergedOcc 0
10 mol 212 unq 0 iso 0 dist 8.53152 13.207 9.26387 12.1367 4.78007 6.41916 numMergedOcc 0
11 mol 214 unq 0 iso 0 dist 8.67902 13.4896 9.81136 19.1374 14.9808 5.69733 numMergedOcc 0
12 mol 218 unq 0 iso 0 dist 6.35646 5.01938 4.61671 10.1372 6.82687 5.98076 numMergedOcc 0
13 mol 218 unq 1 iso 0 dist 5.59354 5.01938 8.44004 10.1372 10.8844 5.98076 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 9.66105 10.0531 8.5434 15.8702 14.8023 7.96759 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 9.66105 10.0531 8.5434 14.1652 5.61953 8.94384 numMergedOcc 0
16 mol 220 unq 2 iso 0 dist 9.70552 5.28769 8.5434 8.41418 14.8023 7.96759 numMergedOcc 0
17 mol 220 unq 3 iso 0 dist 9.70552 5.28769 8.5434 12.531 5.61953 8.94384 numMergedOcc 0
18 mol 220 unq 4 iso 0 dist 9.64006 16.6231 7.86207 19.1842 11.9931 8.58709 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 7.04478 5.16822 6.00654 13.7784 10.1043 8.78008 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 8.4319 6.72716 9.59937 8.77271 8.46058 8.01565 numMergedOcc 0
21 mol 249 unq 0 iso 0 dist 8.21137 7.6558 6.18866 12.4976 6.59067 5.66519 numMergedOcc 0
22 mol 249 unq 1 iso 0 dist 8.21137 11.1949 9.3807 12.4976 6.59067 6.50067 numMergedOcc 0
23 mol 259 unq 0 iso 0 dist 9.98041 11.5702 6.76656 18.8014 9.43627 9.16791 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 9.60879 9.93994 6.23539 17.4444 13.1 9.42812 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 4.9851 4.21241 8.70702 7.25999 8.66375 8.78148 numMergedOcc 0
26 mol 285 unq 1 iso 0 dist 4.9851 10.4106 9.3482 7.25999 8.66375 8.33415 numMergedOcc 0
