0 mol 7 unq 0 iso 0 dist 6.22805 6.96396 7.10621 13.6699 10.789 7.31201 5.99355 5.72491 5.44992 9.55056 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 6.22805 6.96396 7.10621 13.6699 10.789 7.31201 9.08448 9.67579 4.74523 7.57354 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 6.22805 6.96396 7.10621 13.3157 10.515 9.36807 5.99355 5.72491 5.44992 7.45262 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 6.22805 6.96396 7.10621 13.3157 10.515 9.36807 9.08448 9.67579 4.74523 6.96586 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 9.47321 5.91584 8.57077 12.1925 11.4878 6.33889 14.2391 8.83269 11.0722 9.82483 numMergedOcc 0
5 mol 16 unq 0 iso 0 dist 7.46752 6.06561 5.46498 12.3246 6.73355 8.41862 6.76292 6.56335 6.70071 7.40724 numMergedOcc 0
6 mol 16 unq 1 iso 0 dist 7.46752 8.02077 8.71745 12.3246 6.73355 8.16785 6.76292 6.56335 4.50891 7.40724 numMergedOcc 0
7 mol 75 unq 0 iso 0 dist 7.16583 6.77761 7.79912 7.14313 10.0425 5.15851 5.95995 12.5982 9.12189 9.48876 numMergedOcc 0
8 mol 75 unq 1 iso 0 dist 7.118 5.06305 7.79912 9.77241 10.0425 5.15851 9.24529 12.5982 9.12189 9.48876 numMergedOcc 0
9 mol 75 unq 2 iso 0 dist 8.24814 5.06305 8.56639 9.77241 11.8774 5.15851 9.24529 16.199 9.12189 9.48876 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 6.6776 13.7028 9.0018 12.5642 11.0415 9.31887 10.1424 12.6297 13.9336 7.01126 numMergedOcc 0
11 mol 175 unq 1 iso 0 dist 6.6776 13.7028 9.0018 12.5642 11.0415 9.31887 15.0921 15.2721 11.873 6.58434 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 9.07833 9.54619 9.09537 11.7541 6.14208 7.20046 4.97043 7.20392 5.93488 7.345 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 9.07833 9.54619 9.09537 12.342 5.95965 7.13543 4.97043 7.20392 5.93488 9.52987 numMergedOcc 0
14 mol 181 unq 2 iso 0 dist 9.63295 12.5935 7.63312 18.3583 9.60512 7.98142 20.2232 11.6558 9.92777 5.49808 numMergedOcc 0
15 mol 181 unq 3 iso 0 dist 9.63295 12.5935 7.63312 19.9229 13.3389 7.37327 20.2232 11.6558 9.92777 7.96291 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 9.40003 16.922 8.85478 13.7287 6.67959 7.46831 12.2978 6.38157 5.63388 5.10114 numMergedOcc 0
17 mol 214 unq 1 iso 0 dist 8.68385 9.18071 8.85478 10.7631 6.67959 7.46831 11.7781 6.38157 5.63388 5.10114 numMergedOcc 0
18 mol 238 unq 0 iso 0 dist 7.98022 6.3873 5.72887 14.7533 13.069 9.29858 16.9366 11.2809 10.7551 9.47845 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 9.26156 7.10801 7.00034 12.5745 6.26168 7.39747 10.1571 10.2163 5.66732 7.18771 numMergedOcc 0
20 mol 239 unq 1 iso 0 dist 9.26156 7.10801 7.00034 10.2911 5.39146 8.1777 10.1571 10.2163 5.66732 7.94894 numMergedOcc 0
21 mol 248 unq 0 iso 0 dist 6.44967 9.48478 7.69895 9.83514 6.48757 6.07192 4.01898 6.17052 5.99459 8.53148 numMergedOcc 0
22 mol 259 unq 0 iso 0 dist 6.96379 12.7595 7.88519 15.1733 11.6195 7.48005 12.6188 10.5803 5.60748 6.39918 numMergedOcc 0
23 mol 261 unq 0 iso 0 dist 8.50313 13.3163 8.45658 13.5663 5.22253 7.47164 11.2562 8.60026 6.04016 9.24121 numMergedOcc 0
24 mol 261 unq 1 iso 0 dist 7.6414 13.6041 8.45658 12.6505 5.22253 7.47164 13.4429 8.60026 6.04016 9.24121 numMergedOcc 0
