0 mol 44 unq 0 iso 0 dist 7.41011 10.0797 5.81645 13.389 9.70501 9.45566 numMergedOcc 0
1 mol 54 unq 0 iso 0 dist 6.04354 12.2182 9.20373 15.2379 12.1383 4.38047 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 9.91313 11.5851 5.67362 15.5684 5.78327 6.94677 numMergedOcc 0
3 mol 74 unq 0 iso 0 dist 8.46495 11.3868 5.65212 9.3664 5.19847 6.49521 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 6.40355 5.26304 9.61367 12.0927 13.4991 7.75211 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 7.28161 4.00884 6.48163 10.1965 13.8441 7.7913 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 4.98783 4.1125 6.48163 9.59503 13.8441 7.7913 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 9.28645 6.62328 7.03339 7.84249 4.59061 6.09626 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 8.27253 4.09788 8.05937 11.8884 9.90172 8.4733 numMergedOcc 0
9 mol 154 unq 0 iso 0 dist 8.40395 5.80716 5.76862 10.5948 5.55349 5.60184 numMergedOcc 0
10 mol 154 unq 1 iso 0 dist 8.40395 11.2839 5.92763 10.5948 5.55349 7.08477 numMergedOcc 0
11 mol 154 unq 2 iso 0 dist 8.5081 9.10645 5.76862 7.10223 5.55349 5.60184 numMergedOcc 0
12 mol 154 unq 3 iso 0 dist 8.5081 4.02111 5.92763 7.10223 5.55349 7.08477 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.54588 6.48822 9.94274 12.9424 9.95786 9.20646 numMergedOcc 0
14 mol 233 unq 0 iso 0 dist 7.44436 4.73615 8.76329 9.06304 9.31629 9.73592 numMergedOcc 0
15 mol 241 unq 0 iso 0 dist 7.30582 10.7816 9.14228 13.0579 6.26153 9.28598 numMergedOcc 0
16 mol 241 unq 1 iso 0 dist 9.69499 14.8485 9.04127 14.8242 9.69805 9.28598 numMergedOcc 0
17 mol 241 unq 2 iso 0 dist 7.44279 9.73806 9.04127 11.3707 9.69805 9.28598 numMergedOcc 0
18 mol 244 unq 0 iso 0 dist 9.16789 9.01951 5.60146 13.6955 8.71894 8.08939 numMergedOcc 0
19 mol 244 unq 1 iso 0 dist 9.16789 9.01951 5.60146 15.7492 8.52699 7.33574 numMergedOcc 0
20 mol 244 unq 2 iso 0 dist 8.19381 4.38246 5.60146 5.06669 8.71894 8.08939 numMergedOcc 0
21 mol 244 unq 3 iso 0 dist 8.19381 4.38246 5.60146 5.65248 8.52699 7.33574 numMergedOcc 0
22 mol 244 unq 4 iso 0 dist 7.35657 4.38246 9.80249 5.06669 5.36127 8.08939 numMergedOcc 0
23 mol 244 unq 5 iso 0 dist 7.35657 4.38246 9.80249 5.65248 11.2736 7.33574 numMergedOcc 0
24 mol 257 unq 0 iso 0 dist 9.27027 12.4553 6.8256 12.2504 4.3984 9.34004 numMergedOcc 0
25 mol 257 unq 1 iso 0 dist 7.87058 3.63342 6.8256 10.9908 4.3984 9.34004 numMergedOcc 0
26 mol 267 unq 0 iso 0 dist 9.30931 4.36261 5.32817 13.1852 5.59194 9.80577 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 7.40069 9.58852 9.55425 8.35169 4.41308 6.68863 numMergedOcc 0
