0 mol 30 unq 0 iso 0 dist 8.87499 7.15015 6.58841 8.3224 5.38977 9.67807 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 8.87499 7.15015 6.58841 8.71602 5.29629 4.06512 numMergedOcc 0
2 mol 30 unq 2 iso 0 dist 8.87499 7.15015 6.58841 7.54379 9.17076 6.29623 numMergedOcc 0
3 mol 30 unq 3 iso 0 dist 8.87499 3.68549 7.19972 8.3224 5.38977 6.54878 numMergedOcc 0
4 mol 30 unq 4 iso 0 dist 8.87499 3.68549 7.19972 8.71602 5.29629 5.62773 numMergedOcc 0
5 mol 30 unq 5 iso 0 dist 8.87499 3.68549 7.19972 7.54379 9.17076 4.20285 numMergedOcc 0
6 mol 30 unq 6 iso 0 dist 8.2359 7.15015 11.9061 8.3224 5.85756 9.67807 numMergedOcc 0
7 mol 30 unq 7 iso 0 dist 8.2359 7.15015 11.9061 8.71602 10.1951 4.06512 numMergedOcc 0
8 mol 30 unq 8 iso 0 dist 8.2359 7.15015 11.9061 7.54379 8.04261 6.29623 numMergedOcc 0
9 mol 30 unq 9 iso 0 dist 8.2359 3.68549 6.67111 8.3224 5.85756 6.54878 numMergedOcc 0
10 mol 30 unq 10 iso 0 dist 8.2359 3.68549 6.67111 8.71602 10.1951 5.62773 numMergedOcc 0
11 mol 30 unq 11 iso 0 dist 8.2359 3.68549 6.67111 7.54379 8.04261 4.20285 numMergedOcc 0
12 mol 34 unq 0 iso 0 dist 9.32818 8.36524 13.091 5.39587 12.4289 4.55481 numMergedOcc 0
13 mol 34 unq 1 iso 0 dist 9.32818 8.36524 13.091 6.47252 9.67615 13.4762 numMergedOcc 0
14 mol 78 unq 0 iso 0 dist 8.90372 9.29446 13.9318 8.56119 6.6691 9.76194 numMergedOcc 0
15 mol 78 unq 1 iso 0 dist 8.90372 5.8992 7.73661 8.56119 6.6691 5.7558 numMergedOcc 0
16 mol 78 unq 2 iso 0 dist 6.09124 9.29446 4.81535 8.56119 6.09402 9.76194 numMergedOcc 0
17 mol 78 unq 3 iso 0 dist 6.09124 5.8992 6.83613 8.56119 6.09402 5.7558 numMergedOcc 0
18 mol 89 unq 0 iso 0 dist 9.1584 8.85873 10.5017 7.02228 4.72096 6.13636 numMergedOcc 0
19 mol 89 unq 1 iso 0 dist 9.1584 7.3606 5.20015 7.02228 4.72096 4.16955 numMergedOcc 0
20 mol 154 unq 0 iso 0 dist 8.36066 6.44195 6.95651 8.59532 11.4665 4.55687 numMergedOcc 0
21 mol 154 unq 1 iso 0 dist 8.36066 7.34207 4.41003 8.59532 11.4665 13.5599 numMergedOcc 0
22 mol 169 unq 0 iso 0 dist 8.51999 6.28961 8.10912 8.89822 7.26442 5.7891 numMergedOcc 0
23 mol 186 unq 0 iso 0 dist 8.30192 9.52413 11.3614 8.9388 5.72704 15.4336 numMergedOcc 0
24 mol 186 unq 1 iso 0 dist 7.59599 6.0639 9.21913 9.16579 10.9778 7.38602 numMergedOcc 0
25 mol 186 unq 2 iso 0 dist 7.59599 6.0639 9.21913 8.95209 5.74741 11.6282 numMergedOcc 0
26 mol 186 unq 3 iso 0 dist 7.59599 6.91355 11.6591 9.16579 10.9778 4.26355 numMergedOcc 0
27 mol 186 unq 4 iso 0 dist 7.59599 6.91355 11.6591 8.95209 5.74741 10.5033 numMergedOcc 0
28 mol 186 unq 5 iso 0 dist 7.76429 6.0639 11.1768 9.16579 10.1836 7.38602 numMergedOcc 0
29 mol 186 unq 6 iso 0 dist 7.76429 6.0639 11.1768 8.95209 12.4955 11.6282 numMergedOcc 0
30 mol 186 unq 7 iso 0 dist 7.76429 6.91355 6.22624 9.16579 10.1836 4.26355 numMergedOcc 0
31 mol 186 unq 8 iso 0 dist 7.76429 6.91355 6.22624 8.95209 12.4955 10.5033 numMergedOcc 0
32 mol 186 unq 9 iso 0 dist 7.73733 6.0639 7.03438 9.16579 8.79267 7.38602 numMergedOcc 0
33 mol 186 unq 10 iso 0 dist 7.73733 6.0639 7.03438 8.95209 14.6855 11.6282 numMergedOcc 0
34 mol 186 unq 11 iso 0 dist 7.73733 6.91355 5.22317 9.16579 8.79267 4.26355 numMergedOcc 0
35 mol 186 unq 12 iso 0 dist 7.73733 6.91355 5.22317 8.95209 14.6855 10.5033 numMergedOcc 0
36 mol 217 unq 0 iso 0 dist 8.75987 7.58097 12.6895 9.41353 3.64097 13.1665 numMergedOcc 0
37 mol 217 unq 1 iso 0 dist 8.75987 7.58097 12.6895 8.28155 8.43469 13.7271 numMergedOcc 0
38 mol 218 unq 0 iso 0 dist 7.78107 8.95233 9.70376 7.64563 3.85734 6.45316 numMergedOcc 0
39 mol 229 unq 0 iso 0 dist 9.98938 6.32302 4.98446 9.90415 5.41869 5.70473 numMergedOcc 0
40 mol 229 unq 1 iso 0 dist 9.98938 6.32302 4.98446 6.92268 8.87669 4.17276 numMergedOcc 0
41 mol 229 unq 2 iso 0 dist 9.98938 6.88694 9.9295 9.90415 5.41869 7.22525 numMergedOcc 0
42 mol 229 unq 3 iso 0 dist 9.98938 6.88694 9.9295 6.92268 8.87669 4.92403 numMergedOcc 0
43 mol 229 unq 4 iso 0 dist 6.75338 8.53615 4.98446 5.96615 5.41869 5.70473 numMergedOcc 0
44 mol 266 unq 0 iso 0 dist 9.00434 6.95233 9.65978 7.30349 13.2055 6.17213 numMergedOcc 0
45 mol 266 unq 1 iso 0 dist 9.00434 9.61741 18.4434 7.30349 13.2055 10.9352 numMergedOcc 0
46 mol 266 unq 2 iso 0 dist 9.00434 5.61056 13.7874 7.30349 13.2055 4.0027 numMergedOcc 0
