0 mol 7 unq 0 iso 0 dist 9.49232 8.98901 11.3411 16.3136 9.60361 14.3693 numMergedOcc 0
1 mol 12 unq 0 iso 0 dist 6.13335 4.85969 4.13477 9.3276 8.79013 9.79847 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 9.57343 6.46901 10.0786 12.7344 9.72136 15.1676 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 9.57343 6.46901 10.0786 13.9221 4.61355 14.3019 numMergedOcc 0
4 mol 46 unq 2 iso 0 dist 9.57343 9.30547 5.79552 12.7344 9.72136 10.2405 numMergedOcc 0
5 mol 46 unq 3 iso 0 dist 9.57343 9.30547 5.79552 13.9221 4.61355 8.55202 numMergedOcc 0
6 mol 70 unq 0 iso 0 dist 9.28709 9.2794 9.10017 15.9426 8.55467 17.5042 numMergedOcc 0
7 mol 81 unq 0 iso 0 dist 6.99027 9.12919 4.79903 6.10195 7.062 8.38883 numMergedOcc 0
8 mol 122 unq 0 iso 0 dist 6.12598 8.3907 8.66482 6.16219 5.42764 11.0369 numMergedOcc 0
9 mol 123 unq 0 iso 0 dist 9.06373 6.9952 4.81545 8.03795 8.18122 10.119 numMergedOcc 0
10 mol 123 unq 1 iso 0 dist 9.06373 9.30054 11.2125 8.03795 8.18122 14.4351 numMergedOcc 0
11 mol 128 unq 0 iso 0 dist 9.36937 5.32517 8.76554 12.3984 7.56557 12.3617 numMergedOcc 0
12 mol 128 unq 1 iso 0 dist 9.36937 5.32517 8.76554 9.02609 4.93016 9.67042 numMergedOcc 0
13 mol 128 unq 2 iso 0 dist 9.36937 7.6275 6.56049 12.3984 7.56557 11.5207 numMergedOcc 0
14 mol 128 unq 3 iso 0 dist 9.36937 7.6275 6.56049 9.02609 4.93016 9.01072 numMergedOcc 0
15 mol 128 unq 4 iso 0 dist 9.36937 7.4738 13.1723 12.3984 7.56557 18.5956 numMergedOcc 0
16 mol 128 unq 5 iso 0 dist 9.36937 7.4738 13.1723 9.02609 4.93016 14.8708 numMergedOcc 0
17 mol 128 unq 6 iso 0 dist 9.36937 8.88867 7.4928 12.3984 7.56557 12.5339 numMergedOcc 0
18 mol 128 unq 7 iso 0 dist 9.36937 8.88867 7.4928 9.02609 4.93016 9.07603 numMergedOcc 0
19 mol 128 unq 8 iso 0 dist 9.36937 7.04282 5.92897 12.3984 7.56557 12.3846 numMergedOcc 0
20 mol 128 unq 9 iso 0 dist 9.36937 7.04282 5.92897 9.02609 4.93016 8.77539 numMergedOcc 0
21 mol 133 unq 0 iso 0 dist 8.86332 5.63173 4.77272 13.2035 8.64976 11.9149 numMergedOcc 0
22 mol 133 unq 1 iso 0 dist 8.86332 5.63173 4.77272 10.115 9.52159 11.044 numMergedOcc 0
23 mol 233 unq 0 iso 0 dist 5.68392 8.36772 4.69692 5.31928 9.28828 10.8286 numMergedOcc 0
24 mol 233 unq 1 iso 0 dist 5.68392 8.83541 5.49245 5.31928 9.28828 12.5134 numMergedOcc 0
25 mol 233 unq 2 iso 0 dist 5.68392 7.55878 7.41379 5.31928 9.28828 12.6699 numMergedOcc 0
26 mol 278 unq 0 iso 0 dist 8.03252 8.79625 13.4866 5.90283 5.74676 11.2735 numMergedOcc 0
27 mol 278 unq 1 iso 0 dist 8.03252 9.9609 12.3196 5.90283 5.74676 13.6672 numMergedOcc 0
28 mol 287 unq 0 iso 0 dist 6.2587 6.38338 7.88871 9.8719 7.74312 10.251 numMergedOcc 0
29 mol 288 unq 0 iso 0 dist 6.2587 6.38338 7.88871 9.8719 7.74312 10.251 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 6.2587 6.38338 7.88871 9.8719 7.74312 10.251 numMergedOcc 0
31 mol 292 unq 0 iso 0 dist 8.01956 9.05047 10.846 6.81187 6.98961 13.9019 numMergedOcc 0
32 mol 292 unq 1 iso 0 dist 8.01956 7.24072 9.02523 6.81187 6.98961 12.5194 numMergedOcc 0
33 mol 292 unq 2 iso 0 dist 6.88719 8.99187 6.32057 4.14327 6.01636 10.6299 numMergedOcc 0
