0 mol 1 unq 0 iso 0 dist 9.35554 10.9667 9.12196 11.0126 7.94662 7.73435 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 6.84521 10.0977 8.44903 11.2885 5.64171 7.31982 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 5.84326 8.45716 8.63486 14.4742 12.8132 6.91393 numMergedOcc 0
3 mol 56 unq 1 iso 0 dist 5.84326 8.45716 8.63486 16.2833 16.7219 8.40038 numMergedOcc 0
4 mol 154 unq 0 iso 0 dist 7.34207 6.03671 7.72144 14.7075 11.0347 9.71408 numMergedOcc 0
5 mol 163 unq 0 iso 0 dist 7.75045 7.79531 8.38738 12.3296 6.94217 7.3546 numMergedOcc 0
6 mol 186 unq 0 iso 0 dist 8.77347 6.2749 7.20574 13.62 12.7155 7.55358 numMergedOcc 0
7 mol 186 unq 1 iso 0 dist 8.77347 6.2749 7.20574 15.0705 11.2142 8.87818 numMergedOcc 0
8 mol 186 unq 2 iso 0 dist 9.52413 12.1191 9.83476 10.4646 6.87725 8.12349 numMergedOcc 0
9 mol 218 unq 0 iso 0 dist 9.79816 10.888 5.76954 18.5562 10.4526 8.93185 numMergedOcc 0
10 mol 218 unq 1 iso 0 dist 9.79816 8.17702 6.29511 14.0417 11.438 9.06334 numMergedOcc 0
11 mol 225 unq 0 iso 0 dist 9.93754 9.46577 6.6561 12.4537 4.76151 6.53728 numMergedOcc 0
12 mol 235 unq 0 iso 0 dist 5.60236 6.49782 6.39158 11.306 5.72331 9.81305 numMergedOcc 0
13 mol 235 unq 1 iso 0 dist 5.60236 6.49782 6.39158 11.9524 8.33772 6.89118 numMergedOcc 0
14 mol 235 unq 2 iso 0 dist 9.03917 12.526 6.39158 12.3027 5.72331 9.81305 numMergedOcc 0
15 mol 235 unq 3 iso 0 dist 9.03917 12.526 6.39158 14.1047 8.33772 6.89118 numMergedOcc 0
16 mol 240 unq 0 iso 0 dist 7.6664 14.1051 9.47583 17.5311 10.6074 9.53915 numMergedOcc 0
17 mol 258 unq 0 iso 0 dist 9.2067 5.00301 7.99477 8.43941 5.27959 6.47194 numMergedOcc 0
18 mol 264 unq 0 iso 0 dist 8.85887 5.95173 6.42588 11.1782 10.1591 5.74568 numMergedOcc 0
19 mol 264 unq 1 iso 0 dist 6.65233 6.79049 6.14323 10.7398 9.37297 5.74568 numMergedOcc 0
20 mol 294 unq 0 iso 0 dist 7.77765 5.94806 9.13907 5.78275 12.0308 7.41079 numMergedOcc 0
