0 mol 65 unq 0 iso 0 dist 8.70783 9.42411 13.2346 12.8097 8.54555 19.8963 numMergedOcc 0
1 mol 79 unq 0 iso 0 dist 7.54919 6.29801 5.88927 5.88414 7.74901 10.3689 numMergedOcc 0
2 mol 79 unq 1 iso 0 dist 9.12912 8.39378 5.88927 7.71787 7.74901 10.3689 numMergedOcc 0
3 mol 92 unq 0 iso 0 dist 9.14582 9.85185 4.17255 7.88521 8.96747 11.2281 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 8.6701 8.345 12.3169 12.4843 7.13064 18.6848 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 8.6701 6.06155 9.11323 12.4843 7.13064 15.4206 numMergedOcc 0
6 mol 93 unq 2 iso 0 dist 6.85457 8.345 11.9244 12.4843 7.8962 18.6848 numMergedOcc 0
7 mol 93 unq 3 iso 0 dist 6.85457 6.06155 8.52329 12.4843 7.8962 15.4206 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 7.64681 7.40983 7.86339 7.67811 9.46568 8.79886 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 6.37224 7.91691 9.33661 6.89318 9.6403 12.606 numMergedOcc 0
10 mol 114 unq 0 iso 0 dist 7.27601 8.18356 3.67473 6.20949 4.86767 7.4113 numMergedOcc 0
11 mol 120 unq 0 iso 0 dist 6.50614 6.84006 4.26413 4.30031 5.12002 7.06763 numMergedOcc 0
12 mol 120 unq 1 iso 0 dist 9.2903 6.84006 3.64386 4.30031 8.46914 7.06763 numMergedOcc 0
13 mol 120 unq 2 iso 0 dist 9.29305 8.02114 4.26413 8.74749 5.12002 7.06763 numMergedOcc 0
14 mol 123 unq 0 iso 0 dist 8.29394 7.49032 4.10526 7.04318 9.52442 11.4598 numMergedOcc 0
15 mol 123 unq 1 iso 0 dist 5.98534 7.04627 4.10526 5.76997 9.52442 11.4598 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 8.96031 7.82717 14.0517 10.5408 9.2802 18.294 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 8.96031 8.19926 16.0263 10.5408 9.2802 17.7065 numMergedOcc 0
18 mol 186 unq 2 iso 0 dist 8.96031 9.02402 4.4787 10.5408 9.2802 8.0943 numMergedOcc 0
19 mol 194 unq 0 iso 0 dist 7.27978 9.3032 3.7326 11.9253 5.4455 7.56217 numMergedOcc 0
20 mol 257 unq 0 iso 0 dist 9.5789 9.12546 3.96862 13.1181 8.64133 10.5841 numMergedOcc 0
21 mol 257 unq 1 iso 0 dist 9.34175 8.71617 3.96862 15.7248 8.64133 10.5841 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 9.88921 7.08918 6.85669 11.9608 8.86801 9.30035 numMergedOcc 0
23 mol 272 unq 1 iso 0 dist 9.88921 7.08918 6.85669 8.8375 7.15093 9.51185 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 8.31165 8.69111 8.79088 9.05496 8.30195 15.1396 numMergedOcc 0
25 mol 284 unq 0 iso 0 dist 9.95662 5.06373 9.94624 10.1082 4.87349 8.2236 numMergedOcc 0
