0 mol 24 unq 0 iso 0 dist 6.84355 8.48944 12.7555 9.04448 14.1329 11.9756 numMergedOcc 0
1 mol 24 unq 0 iso 1 dist 6.84355 9.04448 14.1329 8.48944 12.7555 11.9756 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.84355 8.48944 12.7555 6.6834 4.79206 13.4516 numMergedOcc 0
3 mol 24 unq 1 iso 1 dist 6.84355 6.6834 4.79206 8.48944 12.7555 13.4516 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.84355 9.04448 14.1329 6.6834 4.79206 10.7501 numMergedOcc 0
5 mol 24 unq 1 iso 1 dist 6.84355 6.6834 4.79206 9.04448 14.1329 10.7501 numMergedOcc 0
6 mol 30 unq 0 iso 0 dist 8.87499 8.3224 5.38977 8.71602 5.29629 7.62116 numMergedOcc 0
7 mol 30 unq 0 iso 1 dist 8.87499 8.71602 5.29629 8.3224 5.38977 7.62116 numMergedOcc 0
8 mol 30 unq 1 iso 0 dist 8.87499 8.3224 5.38977 7.54379 9.17076 8.79591 numMergedOcc 0
9 mol 30 unq 1 iso 1 dist 8.87499 7.54379 9.17076 8.3224 5.38977 8.79591 numMergedOcc 0
10 mol 30 unq 1 iso 0 dist 8.87499 8.71602 5.29629 7.54379 9.17076 5.02289 numMergedOcc 0
11 mol 30 unq 1 iso 1 dist 8.87499 7.54379 9.17076 8.71602 5.29629 5.02289 numMergedOcc 0
12 mol 30 unq 2 iso 0 dist 8.2359 8.3224 5.85756 8.71602 10.1951 7.62116 numMergedOcc 0
13 mol 30 unq 2 iso 1 dist 8.2359 8.71602 10.1951 8.3224 5.85756 7.62116 numMergedOcc 0
14 mol 30 unq 3 iso 0 dist 8.2359 8.3224 5.85756 7.54379 8.04261 8.79591 numMergedOcc 0
15 mol 30 unq 3 iso 1 dist 8.2359 7.54379 8.04261 8.3224 5.85756 8.79591 numMergedOcc 0
16 mol 30 unq 3 iso 0 dist 8.2359 8.71602 10.1951 7.54379 8.04261 5.02289 numMergedOcc 0
17 mol 30 unq 3 iso 1 dist 8.2359 7.54379 8.04261 8.71602 10.1951 5.02289 numMergedOcc 0
18 mol 34 unq 0 iso 0 dist 9.32818 5.39587 12.4289 6.47252 9.67615 11.6209 numMergedOcc 0
19 mol 34 unq 0 iso 1 dist 9.32818 6.47252 9.67615 5.39587 12.4289 11.6209 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 7.59599 9.16579 10.9778 8.95209 5.74741 9.58899 numMergedOcc 0
21 mol 186 unq 0 iso 1 dist 7.59599 8.95209 5.74741 9.16579 10.9778 9.58899 numMergedOcc 0
22 mol 186 unq 1 iso 0 dist 7.76429 9.16579 10.1836 8.95209 12.4955 9.58899 numMergedOcc 0
23 mol 186 unq 1 iso 1 dist 7.76429 8.95209 12.4955 9.16579 10.1836 9.58899 numMergedOcc 0
24 mol 186 unq 2 iso 0 dist 7.73733 9.16579 8.79267 8.95209 14.6855 9.58899 numMergedOcc 0
25 mol 186 unq 2 iso 1 dist 7.73733 8.95209 14.6855 9.16579 8.79267 9.58899 numMergedOcc 0
26 mol 204 unq 0 iso 0 dist 8.76729 7.59666 9.72425 6.51936 7.17392 6.1208 numMergedOcc 0
27 mol 204 unq 0 iso 1 dist 8.76729 6.51936 7.17392 7.59666 9.72425 6.1208 numMergedOcc 0
28 mol 209 unq 0 iso 0 dist 7.55818 7.56664 8.88962 9.65614 10.7239 3.51927 numMergedOcc 0
29 mol 209 unq 0 iso 1 dist 7.55818 9.65614 10.7239 7.56664 8.88962 3.51927 numMergedOcc 0
30 mol 217 unq 0 iso 0 dist 8.75987 9.41353 3.64097 8.28155 8.43469 6.12994 numMergedOcc 0
31 mol 217 unq 0 iso 1 dist 8.75987 8.28155 8.43469 9.41353 3.64097 6.12994 numMergedOcc 0
32 mol 229 unq 0 iso 0 dist 9.98938 9.90415 5.41869 6.92268 8.87669 9.01727 numMergedOcc 0
33 mol 229 unq 0 iso 1 dist 9.98938 6.92268 8.87669 9.90415 5.41869 9.01727 numMergedOcc 0
34 mol 243 unq 0 iso 0 dist 8.10349 9.30388 3.98086 8.96099 4.02386 6.27924 numMergedOcc 0
35 mol 243 unq 0 iso 1 dist 8.10349 8.96099 4.02386 9.30388 3.98086 6.27924 numMergedOcc 0
36 mol 243 unq 1 iso 0 dist 9.62793 9.30388 4.03312 8.96099 9.0802 6.27924 numMergedOcc 0
37 mol 243 unq 1 iso 1 dist 9.62793 8.96099 9.0802 9.30388 4.03312 6.27924 numMergedOcc 0
38 mol 243 unq 2 iso 0 dist 9.98018 9.30388 6.95692 8.96099 9.25649 6.27924 numMergedOcc 0
39 mol 243 unq 2 iso 1 dist 9.98018 8.96099 9.25649 9.30388 6.95692 6.27924 numMergedOcc 0
40 mol 243 unq 3 iso 0 dist 6.33501 5.78671 6.42369 6.56525 4.02386 6.68192 numMergedOcc 0
41 mol 243 unq 3 iso 1 dist 6.33501 6.56525 4.02386 5.78671 6.42369 6.68192 numMergedOcc 0
42 mol 243 unq 4 iso 0 dist 6.33501 5.78671 6.42369 5.46817 8.36019 4.09189 numMergedOcc 0
43 mol 243 unq 4 iso 1 dist 6.33501 5.46817 8.36019 5.78671 6.42369 4.09189 numMergedOcc 0
44 mol 243 unq 4 iso 0 dist 6.33501 6.56525 4.02386 5.46817 8.36019 6.67199 numMergedOcc 0
45 mol 243 unq 4 iso 1 dist 6.33501 5.46817 8.36019 6.56525 4.02386 6.67199 numMergedOcc 0
46 mol 243 unq 5 iso 0 dist 8.46048 5.78671 8.04366 6.56525 9.25649 6.68192 numMergedOcc 0
47 mol 243 unq 5 iso 1 dist 8.46048 6.56525 9.25649 5.78671 8.04366 6.68192 numMergedOcc 0
48 mol 243 unq 6 iso 0 dist 8.46048 5.78671 8.04366 5.46817 11.3398 4.09189 numMergedOcc 0
49 mol 243 unq 6 iso 1 dist 8.46048 5.46817 11.3398 5.78671 8.04366 4.09189 numMergedOcc 0
50 mol 243 unq 6 iso 0 dist 8.46048 6.56525 9.25649 5.46817 11.3398 6.67199 numMergedOcc 0
51 mol 243 unq 6 iso 1 dist 8.46048 5.46817 11.3398 6.56525 9.25649 6.67199 numMergedOcc 0
52 mol 243 unq 7 iso 0 dist 6.67803 5.78671 8.94826 6.56525 6.41173 6.68192 numMergedOcc 0
53 mol 243 unq 7 iso 1 dist 6.67803 6.56525 6.41173 5.78671 8.94826 6.68192 numMergedOcc 0
54 mol 243 unq 8 iso 0 dist 6.67803 5.78671 8.94826 5.46817 5.7044 4.09189 numMergedOcc 0
55 mol 243 unq 8 iso 1 dist 6.67803 5.46817 5.7044 5.78671 8.94826 4.09189 numMergedOcc 0
56 mol 243 unq 8 iso 0 dist 6.67803 6.56525 6.41173 5.46817 5.7044 6.67199 numMergedOcc 0
57 mol 243 unq 8 iso 1 dist 6.67803 5.46817 5.7044 6.56525 6.41173 6.67199 numMergedOcc 0
58 mol 253 unq 0 iso 0 dist 9.78986 9.08259 14.639 8.42325 10.8444 6.88699 numMergedOcc 0
59 mol 253 unq 0 iso 1 dist 9.78986 8.42325 10.8444 9.08259 14.639 6.88699 numMergedOcc 0
