0 mol 4 unq 0 iso 0 dist 8.7041 9.84876 11.2643 5.79308 5.31026 12.5387 11.9832 15.4241 8.57798 14.2537 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 8.7041 9.84876 11.2643 5.79308 5.31026 12.5387 10.8556 16.0212 6.45344 15.6844 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 8.51178 7.04966 9.64649 6.96046 8.79533 12.1205 5.16461 10.4755 7.54797 6.59582 numMergedOcc 0
3 mol 19 unq 0 iso 0 dist 9.79426 9.3147 17.1338 9.27965 9.55978 18.5363 4.55916 13.738 9.65404 10.3962 numMergedOcc 0
4 mol 178 unq 0 iso 0 dist 6.25455 8.14441 5.82281 6.33374 7.82796 10.0941 6.97067 5.71438 7.69328 11.9392 numMergedOcc 0
5 mol 205 unq 0 iso 0 dist 9.89311 7.71155 6.26321 13.8587 8.21112 13.8569 5.98421 11.6319 6.88402 17 numMergedOcc 0
6 mol 205 unq 1 iso 0 dist 9.89311 7.71155 6.26321 9.6353 7.06533 11.3296 5.98421 11.6319 6.88402 13.442 numMergedOcc 0
7 mol 205 unq 2 iso 0 dist 9.89311 7.71155 6.26321 11.7852 5.94835 6.76947 5.98421 11.6319 6.88402 10.5655 numMergedOcc 0
8 mol 205 unq 3 iso 0 dist 7.71155 9.89311 6.26321 11.7852 6.76947 5.94835 17.2287 12.0655 9.69941 5.61877 numMergedOcc 0
9 mol 211 unq 0 iso 0 dist 9.8921 8.50841 8.59334 15.2751 7.15386 11.989 7.02917 11.5744 9.64564 13.5472 numMergedOcc 0
10 mol 211 unq 1 iso 0 dist 9.8921 8.50841 8.59334 17.5039 7.73993 14.4642 7.02917 11.5744 9.64564 17.5221 numMergedOcc 0
11 mol 211 unq 2 iso 0 dist 9.8921 8.50841 8.59334 16.4954 9.45365 10.7444 7.02917 11.5744 9.64564 14.4527 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 7.20255 7.57712 5.88344 6.40358 5.51565 4.3362 6.555 12.5675 9.58724 9.61081 numMergedOcc 0
13 mol 220 unq 1 iso 0 dist 7.20255 7.57712 5.88344 7.36665 9.74776 10.181 6.555 12.5675 9.58724 10.2973 numMergedOcc 0
14 mol 223 unq 0 iso 0 dist 9.29204 5.75896 11.898 4.68566 9.86372 10.1945 6.5658 10.9317 7.22882 7.67951 numMergedOcc 0
15 mol 223 unq 1 iso 0 dist 9.14789 5.75896 13.5741 4.68566 7.70946 10.1945 6.5658 11.6333 7.22882 7.67951 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 9.37276 5.97988 8.07582 5.07348 8.62228 9.14793 8.60417 16.8131 9.79842 13.2815 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 6.6537 9.08719 11.6002 9.80029 7.46044 17.2648 7.00684 13.4292 9.79842 16.2505 numMergedOcc 0
18 mol 258 unq 0 iso 0 dist 7.70189 6.08181 9.86352 5.79358 6.59521 10.9114 9.0655 11.0415 7.66806 10.2781 numMergedOcc 0
