0 mol 25 unq 0 iso 0 dist 7.88087 9.36326 15.8335 8.64255 12.1471 7.685 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 6.50646 7.13638 6.82593 7.33437 12.3807 8.81638 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 8.00221 8.73104 5.29079 4.23724 6.6003 9.80142 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 8.00221 9.31622 5.78769 9.78246 12.2258 8.68586 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 8.00221 9.31622 5.78769 4.23724 6.6003 9.54144 numMergedOcc 0
5 mol 100 unq 0 iso 0 dist 6.98876 6.18729 5.07584 4.73852 11.4822 9.39469 numMergedOcc 0
6 mol 100 unq 1 iso 0 dist 6.98876 6.18729 5.07584 4.58978 7.88564 4.76815 numMergedOcc 0
7 mol 117 unq 0 iso 0 dist 5.38954 9.77482 12.4058 5.17524 7.70533 6.62561 numMergedOcc 0
8 mol 117 unq 1 iso 0 dist 5.38954 9.77482 12.4058 10.7342 14.7579 7.63616 numMergedOcc 0
9 mol 117 unq 2 iso 0 dist 5.38954 9.0428 9.30367 6.3368 10.5232 7.20326 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 7.97262 7.6461 9.82776 4.93029 6.42756 6.93652 numMergedOcc 0
11 mol 141 unq 1 iso 0 dist 7.97262 7.6461 9.82776 5.83329 11.6435 9.54444 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 8.74611 7.08808 9.91975 4.30841 12.4191 6.88137 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 7.9678 9.70674 12.652 12.9245 10.156 9.19704 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 9.4525 5.02756 12.082 5.74363 13.69 7.82944 numMergedOcc 0
15 mol 220 unq 1 iso 0 dist 8.98518 5.02756 5.34316 5.74363 11.1838 7.82944 numMergedOcc 0
16 mol 234 unq 0 iso 0 dist 9.5831 6.553 11.2839 12.2372 15.5559 6.16063 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 5.59164 9.13022 6.23871 4.67735 5.24313 7.67322 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 7.42888 8.20751 5.28906 5.29393 5.73296 6.49982 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 8.13376 5.68415 11.3446 9.03495 10.0766 6.77938 numMergedOcc 0
20 mol 266 unq 0 iso 0 dist 9.84057 6.41474 14.5785 4.97892 12.6622 9.02188 numMergedOcc 0
21 mol 266 unq 1 iso 0 dist 7.87939 6.41474 4.75686 4.97892 12.1634 9.02188 numMergedOcc 0
