0 mol 8 unq 0 iso 0 dist 6.68091 7.08043 6.92865 12.9683 8.95363 7.8922 numMergedOcc 0
1 mol 38 unq 0 iso 0 dist 7.96306 11.1811 8.86547 14.9206 9.36454 7.54179 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.72833 4.61096 8.54845 12.6638 14.6671 8.63486 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 9.41952 5.85228 6.46655 14.4867 9.70283 8.64015 numMergedOcc 0
4 mol 71 unq 0 iso 0 dist 8.39608 4.93292 8.21553 7.23173 11.7226 7.77916 numMergedOcc 0
5 mol 71 unq 1 iso 0 dist 7.28815 6.53623 8.21553 13.0117 11.7226 7.77916 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 8.09675 14.4838 9.89021 19.6446 16.3451 8.03303 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 9.02753 12.3838 9.89021 18.1745 16.3451 8.03303 numMergedOcc 0
8 mol 103 unq 0 iso 0 dist 8.1375 8.44658 7.55805 12.8121 8.4354 9.44561 numMergedOcc 0
9 mol 124 unq 0 iso 0 dist 9.7589 9.34008 7.23052 17.2693 10.0311 8.58188 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 5.9962 4.58263 8.96061 6.0733 5.94764 8.56003 numMergedOcc 0
11 mol 133 unq 1 iso 0 dist 8.61448 10.1805 8.96061 12.0967 5.94764 8.56003 numMergedOcc 0
12 mol 154 unq 0 iso 0 dist 7.63904 5.5065 9.04554 13.113 13.8936 7.72144 numMergedOcc 0
13 mol 163 unq 0 iso 0 dist 6.89529 4.12904 6.56115 5.80513 11.7732 8.38738 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.73634 8.27755 6.86297 14.4778 8.88762 6.85302 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 9.73634 8.27755 6.86297 16.3277 7.55335 9.98215 numMergedOcc 0
16 mol 188 unq 0 iso 0 dist 9.4789 4.04545 7.95028 11.8182 9.91112 8.57261 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 4.45738 10.6493 7.7292 15.8349 12.0796 6.85441 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 5.33103 3.84723 6.53736 7.31388 5.06201 5.37446 numMergedOcc 0
19 mol 210 unq 1 iso 0 dist 9.01301 3.84723 8.18851 7.31388 6.66834 5.37446 numMergedOcc 0
20 mol 236 unq 0 iso 0 dist 8.20542 4.15973 6.36941 8.38439 7.05684 8.50331 numMergedOcc 0
21 mol 258 unq 0 iso 0 dist 9.17911 17.1229 8.81059 24.2368 15.4617 7.99477 numMergedOcc 0
22 mol 258 unq 1 iso 0 dist 9.17911 17.1229 8.81059 19.0514 11.0527 7.86627 numMergedOcc 0
23 mol 258 unq 2 iso 0 dist 9.17911 15.539 9.12006 19.0514 11.0527 7.93574 numMergedOcc 0
24 mol 258 unq 3 iso 0 dist 9.52903 7.52881 8.81059 11.329 15.4617 7.99477 numMergedOcc 0
25 mol 258 unq 4 iso 0 dist 9.52903 7.52881 8.81059 11.7075 11.0527 7.86627 numMergedOcc 0
26 mol 258 unq 5 iso 0 dist 9.52903 12.3042 9.12006 11.7075 11.0527 7.93574 numMergedOcc 0
27 mol 272 unq 0 iso 0 dist 7.38085 5.26991 8.82094 12.6659 9.7816 9.05222 numMergedOcc 0
