0 mol 24 unq 0 iso 0 dist 6.2004 6.01284 6.86136 5.02954 4.11146 3.33439 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 6.2004 9.45579 7.31321 5.02954 4.11146 4.56606 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.5053 6.38243 4.76998 9.41425 8.58071 4.73981 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.59316 9.80137 17.3353 5.54554 8.98812 10.9307 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 7.59316 9.80137 17.3353 6.84514 3.50984 16.0168 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 7.59316 9.80137 17.3353 8.95402 12.69 11.0434 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 7.59316 8.34893 15.8613 5.54554 8.98812 10.9184 numMergedOcc 0
7 mol 48 unq 4 iso 0 dist 7.59316 8.34893 15.8613 6.84514 3.50984 14.9962 numMergedOcc 0
8 mol 48 unq 5 iso 0 dist 7.59316 8.34893 15.8613 8.95402 12.69 12.4168 numMergedOcc 0
9 mol 48 unq 6 iso 0 dist 7.51285 9.85865 17.3314 5.5232 9.01489 11.1315 numMergedOcc 0
10 mol 48 unq 7 iso 0 dist 7.51285 9.85865 17.3314 7.05619 3.65036 16.1553 numMergedOcc 0
11 mol 48 unq 8 iso 0 dist 7.51285 8.74946 16.1572 5.5232 9.01489 11.3739 numMergedOcc 0
12 mol 48 unq 9 iso 0 dist 7.51285 8.74946 16.1572 7.05619 3.65036 15.5559 numMergedOcc 0
13 mol 63 unq 0 iso 0 dist 5.53589 7.4515 6.23298 4.92457 3.23074 4.73277 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 7.62738 7.69861 13.0054 8.59337 12.1293 9.21869 numMergedOcc 0
15 mol 73 unq 1 iso 0 dist 7.62738 7.69861 13.0054 7.66942 15.0139 6.06973 numMergedOcc 0
16 mol 93 unq 0 iso 0 dist 7.62611 7.8435 14.9656 6.46217 6.4154 13.6138 numMergedOcc 0
17 mol 93 unq 1 iso 0 dist 7.62611 5.99269 11.5397 6.46217 6.4154 12.3588 numMergedOcc 0
18 mol 93 unq 2 iso 0 dist 7.62611 5.71763 5.43515 6.46217 6.4154 4.98621 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 6.95372 7.16698 6.11087 8.56866 6.36052 3.37746 numMergedOcc 0
20 mol 143 unq 1 iso 0 dist 6.95372 7.16698 6.11087 5.66207 4.5497 8.92479 numMergedOcc 0
21 mol 143 unq 2 iso 0 dist 6.95372 8.68663 4.06908 8.56866 6.36052 8.45583 numMergedOcc 0
22 mol 143 unq 3 iso 0 dist 6.95372 8.68663 4.06908 5.66207 4.5497 5.94217 numMergedOcc 0
23 mol 147 unq 0 iso 0 dist 7.25644 9.43989 3.88427 7.19893 13.5462 15.2813 numMergedOcc 0
24 mol 147 unq 1 iso 0 dist 7.25644 9.43989 3.88427 6.37938 13.2259 14.3635 numMergedOcc 0
25 mol 152 unq 0 iso 0 dist 5.06613 6.09987 3.87512 5.42715 5.83776 6.15601 numMergedOcc 0
26 mol 152 unq 1 iso 0 dist 5.06613 6.09987 3.87512 9.70575 11.2086 12.1717 numMergedOcc 0
27 mol 158 unq 0 iso 0 dist 6.76055 6.11331 11.3715 8.06621 9.64397 11.6769 numMergedOcc 0
28 mol 158 unq 1 iso 0 dist 9.36343 6.11331 14.1217 8.06621 5.16839 11.6769 numMergedOcc 0
29 mol 182 unq 0 iso 0 dist 8.2169 7.88014 9.19427 8.62437 7.36876 10.0832 numMergedOcc 0
30 mol 182 unq 1 iso 0 dist 8.2169 7.88014 9.19427 7.07405 4.17332 5.19107 numMergedOcc 0
31 mol 182 unq 2 iso 0 dist 8.52103 7.88014 7.17714 8.62437 3.73864 10.0832 numMergedOcc 0
32 mol 182 unq 3 iso 0 dist 8.52103 7.88014 7.17714 7.07405 3.85553 5.19107 numMergedOcc 0
33 mol 210 unq 0 iso 0 dist 5.57779 9.14831 12.2656 8.83523 5.88175 16.3997 numMergedOcc 0
34 mol 210 unq 1 iso 0 dist 7.05649 9.14831 7.76842 8.83523 9.89707 16.3997 numMergedOcc 0
35 mol 210 unq 2 iso 0 dist 6.78579 9.14831 3.93305 8.83523 13.4242 16.3997 numMergedOcc 0
36 mol 218 unq 0 iso 0 dist 9.32945 8.04838 6.95765 6.62738 7.3057 9.10705 numMergedOcc 0
37 mol 218 unq 1 iso 0 dist 9.32945 8.04838 6.95765 7.13254 10.5867 8.25033 numMergedOcc 0
38 mol 230 unq 0 iso 0 dist 8.34416 7.07833 6.1373 6.31092 9.70239 5.53923 numMergedOcc 0
39 mol 230 unq 1 iso 0 dist 6.34832 7.07833 6.19535 6.31092 6.2222 5.53923 numMergedOcc 0
40 mol 234 unq 0 iso 0 dist 6.00582 8.52295 5.96499 6.58003 3.64991 4.70248 numMergedOcc 0
41 mol 264 unq 0 iso 0 dist 7.21655 7.14086 13.0036 8.78525 10.197 10.1726 numMergedOcc 0
