0 mol 11 unq 0 iso 0 dist 9.42442 6.42494 8.68636 8.22997 12.7318 5.91043 numMergedOcc 0
1 mol 11 unq 0 iso 1 dist 6.42494 9.42442 8.68636 8.22997 5.91043 12.7318 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 8.07112 6.42494 4.1001 8.40993 6.17558 5.97265 numMergedOcc 0
3 mol 11 unq 1 iso 1 dist 6.42494 8.07112 4.1001 8.40993 5.97265 6.17558 numMergedOcc 0
4 mol 46 unq 0 iso 0 dist 9.14996 9.47718 14.9502 9.50444 14.3159 10.8201 numMergedOcc 0
5 mol 46 unq 0 iso 1 dist 9.47718 9.14996 14.9502 9.50444 10.8201 14.3159 numMergedOcc 0
6 mol 46 unq 1 iso 0 dist 9.14996 8.9459 16.2907 9.50444 14.3159 4.72547 numMergedOcc 0
7 mol 46 unq 1 iso 1 dist 8.9459 9.14996 16.2907 9.50444 4.72547 14.3159 numMergedOcc 0
8 mol 46 unq 1 iso 0 dist 9.47718 8.9459 10.9654 9.50444 10.8201 4.72547 numMergedOcc 0
9 mol 46 unq 1 iso 1 dist 8.9459 9.47718 10.9654 9.50444 4.72547 10.8201 numMergedOcc 0
10 mol 59 unq 0 iso 0 dist 5.81747 6.81975 3.8971 7.69638 5.87788 5.46359 numMergedOcc 0
11 mol 59 unq 0 iso 1 dist 6.81975 5.81747 3.8971 7.69638 5.46359 5.87788 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 9.53794 9.84346 9.6334 9.4486 18.0271 18.5554 numMergedOcc 0
13 mol 78 unq 0 iso 1 dist 9.84346 9.53794 9.6334 9.4486 18.5554 18.0271 numMergedOcc 0
14 mol 92 unq 0 iso 0 dist 9.16403 9.59503 14.0753 5.93987 3.56424 12.49 numMergedOcc 0
15 mol 92 unq 0 iso 1 dist 9.59503 9.16403 14.0753 5.93987 12.49 3.56424 numMergedOcc 0
16 mol 92 unq 1 iso 0 dist 9.16403 9.59503 14.0753 7.7913 10.4698 4.1125 numMergedOcc 0
17 mol 92 unq 1 iso 1 dist 9.59503 9.16403 14.0753 7.7913 4.1125 10.4698 numMergedOcc 0
18 mol 92 unq 2 iso 0 dist 9.59503 9.61119 7.25233 5.62309 11.9687 11.8069 numMergedOcc 0
19 mol 92 unq 2 iso 1 dist 9.61119 9.59503 7.25233 5.62309 11.8069 11.9687 numMergedOcc 0
20 mol 92 unq 3 iso 0 dist 9.59503 9.61119 7.25233 7.11438 12.841 15.4853 numMergedOcc 0
21 mol 92 unq 3 iso 1 dist 9.61119 9.59503 7.25233 7.11438 15.4853 12.841 numMergedOcc 0
22 mol 163 unq 0 iso 0 dist 7.5447 9.04757 11.4601 9.62943 14.0837 6.09134 numMergedOcc 0
23 mol 163 unq 0 iso 1 dist 9.04757 7.5447 11.4601 9.62943 6.09134 14.0837 numMergedOcc 0
24 mol 169 unq 0 iso 0 dist 9.83308 8.97159 12.4235 5.51388 9.12553 12.8642 numMergedOcc 0
25 mol 169 unq 0 iso 1 dist 8.97159 9.83308 12.4235 5.51388 12.8642 9.12553 numMergedOcc 0
26 mol 169 unq 1 iso 0 dist 8.44483 9.79864 8.84626 7.91434 13.754 9.38287 numMergedOcc 0
27 mol 169 unq 1 iso 1 dist 9.79864 8.44483 8.84626 7.91434 9.38287 13.754 numMergedOcc 0
28 mol 169 unq 2 iso 0 dist 8.44483 9.79864 8.84626 7.79437 15.222 13.8794 numMergedOcc 0
29 mol 169 unq 2 iso 1 dist 9.79864 8.44483 8.84626 7.79437 13.8794 15.222 numMergedOcc 0
30 mol 169 unq 3 iso 0 dist 8.44483 9.73241 16.2413 7.91434 13.754 4.80754 numMergedOcc 0
31 mol 169 unq 3 iso 1 dist 9.73241 8.44483 16.2413 7.91434 4.80754 13.754 numMergedOcc 0
32 mol 169 unq 4 iso 0 dist 8.44483 9.73241 16.2413 7.79437 15.222 8.15907 numMergedOcc 0
33 mol 169 unq 4 iso 1 dist 9.73241 8.44483 16.2413 7.79437 8.15907 15.222 numMergedOcc 0
34 mol 169 unq 3 iso 0 dist 9.79864 9.73241 11.079 7.91434 9.38287 4.80754 numMergedOcc 0
35 mol 169 unq 3 iso 1 dist 9.73241 9.79864 11.079 7.91434 4.80754 9.38287 numMergedOcc 0
36 mol 169 unq 4 iso 0 dist 9.79864 9.73241 11.079 7.79437 13.8794 8.15907 numMergedOcc 0
37 mol 169 unq 4 iso 1 dist 9.73241 9.79864 11.079 7.79437 8.15907 13.8794 numMergedOcc 0
38 mol 176 unq 0 iso 0 dist 7.4839 9.70481 10.4403 9.30303 4.44432 8.5937 numMergedOcc 0
39 mol 176 unq 0 iso 1 dist 9.70481 7.4839 10.4403 9.30303 8.5937 4.44432 numMergedOcc 0
40 mol 176 unq 1 iso 0 dist 7.4839 6.59532 6.6147 9.30303 4.44432 5.2357 numMergedOcc 0
41 mol 176 unq 1 iso 1 dist 6.59532 7.4839 6.6147 9.30303 5.2357 4.44432 numMergedOcc 0
42 mol 176 unq 1 iso 0 dist 9.70481 6.59532 4.22281 9.30303 8.5937 5.2357 numMergedOcc 0
43 mol 176 unq 1 iso 1 dist 6.59532 9.70481 4.22281 9.30303 5.2357 8.5937 numMergedOcc 0
44 mol 210 unq 0 iso 0 dist 9.718 8.61629 4.02543 9.26092 9.53964 5.82101 numMergedOcc 0
45 mol 210 unq 0 iso 1 dist 8.61629 9.718 4.02543 9.26092 5.82101 9.53964 numMergedOcc 0
46 mol 244 unq 0 iso 0 dist 5.06669 5.65248 6.37954 5.79898 10.6799 8.05133 numMergedOcc 0
47 mol 244 unq 0 iso 1 dist 5.65248 5.06669 6.37954 5.79898 8.05133 10.6799 numMergedOcc 0
48 mol 278 unq 0 iso 0 dist 9.60643 7.79408 5.54418 6.81257 5.04243 4.74121 numMergedOcc 0
49 mol 278 unq 0 iso 1 dist 7.79408 9.60643 5.54418 6.81257 4.74121 5.04243 numMergedOcc 0
