0 mol 21 unq 0 iso 0 dist 8.6232 7.63222 7.04837 5.25936 12.9338 9.53277 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 7.69637 8.14598 5.37421 14.3935 7.61183 7.7447 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.53081 6.68961 5.93341 10.1874 10.3437 6.17378 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 5.06188 7.78899 4.55422 10.1404 11.0811 8.29196 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 9.06142 6.34748 9.83589 5.58299 12.9604 6.51117 numMergedOcc 0
5 mol 56 unq 1 iso 0 dist 8.41264 6.34748 12.3293 5.58299 13.8827 6.51117 numMergedOcc 0
6 mol 67 unq 0 iso 0 dist 8.27009 6.44825 11.2455 8.43533 15.7437 5.88409 numMergedOcc 0
7 mol 67 unq 1 iso 0 dist 5.80736 6.44825 3.83735 8.43533 9.10001 5.88409 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 5.73235 6.14248 6.1999 5.50078 9.50939 5.45099 numMergedOcc 0
9 mol 76 unq 1 iso 0 dist 5.73235 6.14248 6.1999 11.6055 13.4154 8.44765 numMergedOcc 0
10 mol 76 unq 2 iso 0 dist 5.73235 6.14248 6.1999 13.5729 15.0873 9.06643 numMergedOcc 0
11 mol 76 unq 3 iso 0 dist 7.48127 6.97936 6.1999 11.6853 9.50939 5.45099 numMergedOcc 0
12 mol 76 unq 4 iso 0 dist 7.48127 6.97936 6.1999 15.0489 13.4154 8.44765 numMergedOcc 0
13 mol 76 unq 5 iso 0 dist 7.48127 6.97936 6.1999 14.2393 15.0873 9.06643 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 6.30896 6.84952 6.40382 4.52783 4.36944 7.14813 numMergedOcc 0
15 mol 139 unq 0 iso 0 dist 9.70154 6.79625 3.82037 5.4082 12.2076 8.83962 numMergedOcc 0
16 mol 139 unq 1 iso 0 dist 8.78382 7.20542 3.82037 7.77973 12.2076 8.83962 numMergedOcc 0
17 mol 158 unq 0 iso 0 dist 9.96635 9.53944 5.47558 12.6695 9.98554 9.44964 numMergedOcc 0
18 mol 171 unq 0 iso 0 dist 6.19457 9.67711 10.9652 14.9311 18.1562 9.68512 numMergedOcc 0
19 mol 182 unq 0 iso 0 dist 6.38335 5.61979 5.2973 5.36021 7.52751 8.07678 numMergedOcc 0
20 mol 192 unq 0 iso 0 dist 7.36571 5.77035 6.62595 5.54406 12.212 8.23162 numMergedOcc 0
21 mol 192 unq 1 iso 0 dist 9.80122 5.77035 9.6618 5.54406 13.403 8.23162 numMergedOcc 0
22 mol 192 unq 2 iso 0 dist 9.17137 5.77035 12.1003 5.54406 14.4012 8.23162 numMergedOcc 0
23 mol 198 unq 0 iso 0 dist 9.87574 7.7619 4.58443 5.46544 7.95437 7.04521 numMergedOcc 0
24 mol 198 unq 1 iso 0 dist 9.87574 7.7619 4.58443 6.14119 10.7148 8.85265 numMergedOcc 0
25 mol 204 unq 0 iso 0 dist 6.20044 5.81438 7.35194 10.6524 12.8257 8.23717 numMergedOcc 0
26 mol 204 unq 1 iso 0 dist 6.20044 5.81438 7.35194 9.88337 13.4001 7.98864 numMergedOcc 0
27 mol 204 unq 2 iso 0 dist 8.41232 5.81438 5.87202 10.6524 13.697 8.23717 numMergedOcc 0
28 mol 204 unq 3 iso 0 dist 8.41232 5.81438 5.87202 9.88337 13.8337 7.98864 numMergedOcc 0
29 mol 205 unq 0 iso 0 dist 5.86839 6.50586 3.73699 4.51847 4.93303 7.88986 numMergedOcc 0
30 mol 205 unq 1 iso 0 dist 5.86839 6.50586 3.73699 10.9814 9.95859 7.4185 numMergedOcc 0
31 mol 214 unq 0 iso 0 dist 5.86911 8.44407 4.54444 10.4614 11.8306 9.59928 numMergedOcc 0
32 mol 214 unq 1 iso 0 dist 5.86911 6.0155 7.05353 10.4614 11.8306 7.70062 numMergedOcc 0
33 mol 214 unq 2 iso 0 dist 5.86911 6.0155 7.05353 9.84398 12.591 7.66702 numMergedOcc 0
34 mol 214 unq 3 iso 0 dist 5.86911 8.89981 12.9344 13.9172 19.043 8.7434 numMergedOcc 0
35 mol 214 unq 4 iso 0 dist 7.89258 8.44407 5.33718 10.4614 12.2241 9.59928 numMergedOcc 0
36 mol 214 unq 5 iso 0 dist 7.89258 6.0155 5.12324 10.4614 12.2241 7.70062 numMergedOcc 0
37 mol 214 unq 6 iso 0 dist 7.89258 6.0155 5.12324 9.84398 12.6869 7.66702 numMergedOcc 0
38 mol 214 unq 7 iso 0 dist 7.89258 8.89981 12.8738 13.9172 20.4183 8.7434 numMergedOcc 0
39 mol 225 unq 0 iso 0 dist 7.65121 8.94981 11.8703 10.8002 15.823 8.74463 numMergedOcc 0
40 mol 226 unq 0 iso 0 dist 8.74399 8.31266 5.27153 7.27859 11.9419 9.07313 numMergedOcc 0
41 mol 255 unq 0 iso 0 dist 7.57779 7.58813 8.06922 13.7865 16.6364 8.7958 numMergedOcc 0
42 mol 285 unq 0 iso 0 dist 7.872 6.24134 11.5704 4.57431 12.2776 7.73438 numMergedOcc 0
43 mol 285 unq 1 iso 0 dist 6.32984 6.24134 4.4744 4.57431 9.58965 7.73438 numMergedOcc 0
44 mol 286 unq 0 iso 0 dist 6.83763 6.64391 3.67621 12.1288 12.387 8.75926 numMergedOcc 0
45 mol 292 unq 0 iso 0 dist 5.83342 9.24101 5.90311 9.41407 11.7742 9.56933 numMergedOcc 0
