0 mol 2 unq 0 iso 0 dist 9.02628 6.89072 3.51035 9.78005 9.7009 10.5078 9.5866 10.3327 8.3726 10.1733 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 8.58588 7.25138 9.92911 8.7531 9.02466 14.2375 11.1544 13.9159 7.01397 19.2967 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 6.26491 9.40699 9.8511 8.56269 3.13977 12.9011 12.0479 16.0024 8.73208 19.0734 numMergedOcc 0
3 mol 88 unq 1 iso 0 dist 6.26491 9.40699 9.8511 8.56269 3.13977 12.9011 9.40927 12.9239 5.60174 16.023 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 4.98783 7.29864 7.64986 7.7399 4.5216 11.8229 14.7098 12.7317 9.60046 16.7272 numMergedOcc 0
5 mol 93 unq 0 iso 0 dist 8.55124 5.10693 7.41642 6.58814 6.51388 2.81832 4.1947 12.7036 8.24402 10.1292 numMergedOcc 0
6 mol 93 unq 1 iso 0 dist 8.55124 5.10693 7.41642 6.13459 10.4066 10.7776 4.1947 12.7036 8.24402 7.14241 numMergedOcc 0
7 mol 93 unq 2 iso 0 dist 8.55124 5.10693 7.41642 7.54391 7.0544 10.4844 4.1947 12.7036 8.24402 10.5252 numMergedOcc 0
8 mol 93 unq 3 iso 0 dist 8.55124 6.58814 6.51388 5.10693 7.41642 2.81832 9.45097 12.5054 9.44156 10.7142 numMergedOcc 0
9 mol 93 unq 4 iso 0 dist 8.55124 6.58814 6.51388 6.13459 10.4066 11.7564 9.45097 12.5054 9.44156 12.0633 numMergedOcc 0
10 mol 93 unq 5 iso 0 dist 8.55124 6.58814 6.51388 7.54391 7.0544 10.3262 9.45097 12.5054 9.44156 11.0168 numMergedOcc 0
11 mol 93 unq 6 iso 0 dist 8.55124 6.13459 10.4066 5.10693 7.41642 10.7776 4.1947 12.7036 7.14241 8.24402 numMergedOcc 0
12 mol 93 unq 7 iso 0 dist 8.55124 6.13459 10.4066 6.58814 6.51388 11.7564 4.1947 12.7036 7.14241 10.1292 numMergedOcc 0
13 mol 93 unq 8 iso 0 dist 8.55124 6.13459 10.4066 7.54391 7.0544 5.02964 4.1947 12.7036 7.14241 10.5252 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 8.52322 4.37577 8.70013 6.99587 7.93285 3.09727 7.99002 16.0086 8.35588 11.1673 numMergedOcc 0
15 mol 244 unq 0 iso 0 dist 8.19381 5.16859 5.2958 4.79207 7.02866 5.86449 8.49995 6.2667 9.07512 9.12728 numMergedOcc 0
16 mol 244 unq 1 iso 0 dist 8.93421 5.16859 11.2661 4.79207 13.4101 5.86449 8.49995 15.3246 9.07512 9.12728 numMergedOcc 0
17 mol 244 unq 2 iso 0 dist 7.35657 5.16859 7.64875 4.79207 11.5997 5.86449 8.49995 10.9581 9.07512 9.12728 numMergedOcc 0
18 mol 244 unq 3 iso 0 dist 6.19605 5.16859 9.20762 4.79207 9.06024 5.86449 8.49995 14.6084 9.07512 9.12728 numMergedOcc 0
19 mol 260 unq 0 iso 0 dist 6.23198 9.46576 12.9904 7.88108 5.76999 9.93488 9.87568 13.9457 4.76164 12.6573 numMergedOcc 0
20 mol 286 unq 0 iso 0 dist 9.02971 8.87916 7.36907 8.27359 6.33854 11.4954 6.87474 12.0616 6.89373 13.8626 numMergedOcc 0
21 mol 286 unq 1 iso 0 dist 9.02971 8.87916 7.36907 8.14957 6.85148 12.5721 6.87474 12.0616 6.89373 14.2041 numMergedOcc 0
22 mol 294 unq 0 iso 0 dist 6.33332 7.48987 7.0236 8.35637 3.65046 10.1889 8.43044 13.2129 8.83359 15.6746 numMergedOcc 0
