0 mol 2 unq 0 iso 0 dist 9.08872 11.6166 7.37296 5.30739 9.9859 15.0954 numMergedOcc 0
1 mol 2 unq 0 iso 1 dist 7.37296 11.6166 9.08872 15.0954 9.9859 5.30739 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 9.67498 17.0748 9.32945 8.88491 8.94586 11.8191 numMergedOcc 0
3 mol 7 unq 0 iso 1 dist 9.32945 17.0748 9.67498 11.8191 8.94586 8.88491 numMergedOcc 0
4 mol 12 unq 0 iso 0 dist 6.65398 6.90032 5.9021 5.33905 4.49007 7.81704 numMergedOcc 0
5 mol 12 unq 0 iso 1 dist 5.9021 6.90032 6.65398 7.81704 4.49007 5.33905 numMergedOcc 0
6 mol 64 unq 0 iso 0 dist 9.3473 6.90646 8.14932 14.0821 8.8633 10.713 numMergedOcc 0
7 mol 64 unq 0 iso 1 dist 8.14932 6.90646 9.3473 10.713 8.8633 14.0821 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 8.60363 16.6115 9.27331 15.52 9.53327 6.41591 numMergedOcc 0
9 mol 73 unq 0 iso 1 dist 9.27331 16.6115 8.60363 6.41591 9.53327 15.52 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 7.11187 9.81157 6.60356 12.8792 9.95103 10.0156 numMergedOcc 0
11 mol 100 unq 0 iso 1 dist 6.60356 9.81157 7.11187 10.0156 9.95103 12.8792 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.07294 12.1681 7.50126 12.7741 8.70392 6.52556 numMergedOcc 0
13 mol 133 unq 0 iso 1 dist 7.50126 12.1681 9.07294 6.52556 8.70392 12.7741 numMergedOcc 0
14 mol 183 unq 0 iso 0 dist 6.21267 7.42362 7.41743 6.19534 5.5781 5.59412 numMergedOcc 0
15 mol 183 unq 0 iso 1 dist 7.41743 7.42362 6.21267 5.59412 5.5781 6.19534 numMergedOcc 0
16 mol 189 unq 0 iso 0 dist 7.04604 8.91303 5.11059 6.37312 9.71563 10.6364 numMergedOcc 0
17 mol 189 unq 0 iso 1 dist 5.11059 8.91303 7.04604 10.6364 9.71563 6.37312 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 9.68829 9.49253 7.75205 10.2119 9.28818 10.1438 numMergedOcc 0
19 mol 205 unq 0 iso 1 dist 7.75205 9.49253 9.68829 10.1438 9.28818 10.2119 numMergedOcc 0
20 mol 210 unq 0 iso 0 dist 6.24111 4.80965 9.00343 6.15611 8.87054 10.7435 numMergedOcc 0
21 mol 210 unq 0 iso 1 dist 9.00343 4.80965 6.24111 10.7435 8.87054 6.15611 numMergedOcc 0
22 mol 210 unq 1 iso 0 dist 6.24111 6.68286 6.41444 6.15611 8.87054 7.26107 numMergedOcc 0
23 mol 210 unq 1 iso 1 dist 6.41444 6.68286 6.24111 7.26107 8.87054 6.15611 numMergedOcc 0
24 mol 210 unq 1 iso 0 dist 9.00343 9.50065 6.41444 10.7435 8.87054 7.26107 numMergedOcc 0
25 mol 210 unq 1 iso 1 dist 6.41444 9.50065 9.00343 7.26107 8.87054 10.7435 numMergedOcc 0
26 mol 219 unq 0 iso 0 dist 4.67452 8.93116 9.86916 6.66401 9.30312 13.9364 numMergedOcc 0
27 mol 219 unq 0 iso 1 dist 9.86916 8.93116 4.67452 13.9364 9.30312 6.66401 numMergedOcc 0
28 mol 220 unq 0 iso 0 dist 9.54279 7.70051 8.85132 11.9102 6.88259 10.309 numMergedOcc 0
29 mol 220 unq 0 iso 1 dist 8.85132 7.70051 9.54279 10.309 6.88259 11.9102 numMergedOcc 0
30 mol 223 unq 0 iso 0 dist 6.03408 7.75335 7.80764 5.25583 6.64193 10.5593 numMergedOcc 0
31 mol 223 unq 0 iso 1 dist 7.80764 7.75335 6.03408 10.5593 6.64193 5.25583 numMergedOcc 0
32 mol 224 unq 0 iso 0 dist 7.47122 11.1434 6.6537 5.93235 6.48885 6.66792 numMergedOcc 0
33 mol 224 unq 0 iso 1 dist 6.6537 11.1434 7.47122 6.66792 6.48885 5.93235 numMergedOcc 0
34 mol 233 unq 0 iso 0 dist 7.21238 9.20332 9.80985 13.608 9.97082 7.53414 numMergedOcc 0
35 mol 233 unq 0 iso 1 dist 9.80985 9.20332 7.21238 7.53414 9.97082 13.608 numMergedOcc 0
36 mol 259 unq 0 iso 0 dist 8.73077 5.25969 6.76656 11.4974 9.69025 7.39099 numMergedOcc 0
37 mol 259 unq 0 iso 1 dist 6.76656 5.25969 8.73077 7.39099 9.69025 11.4974 numMergedOcc 0
38 mol 266 unq 0 iso 0 dist 6.58277 6.70676 8.42706 14.2081 9.45876 16.3962 numMergedOcc 0
39 mol 266 unq 0 iso 1 dist 8.42706 6.70676 6.58277 16.3962 9.45876 14.2081 numMergedOcc 0
40 mol 266 unq 1 iso 0 dist 6.58277 13.1611 8.12204 14.2081 9.45876 5.46666 numMergedOcc 0
41 mol 266 unq 1 iso 1 dist 8.12204 13.1611 6.58277 5.46666 9.45876 14.2081 numMergedOcc 0
42 mol 266 unq 1 iso 0 dist 8.42706 16.4476 8.12204 16.3962 9.45876 5.46666 numMergedOcc 0
43 mol 266 unq 1 iso 1 dist 8.12204 16.4476 8.42706 5.46666 9.45876 16.3962 numMergedOcc 0
44 mol 274 unq 0 iso 0 dist 9.07452 10.1431 6.44266 16.1753 8.30714 7.28382 numMergedOcc 0
45 mol 274 unq 0 iso 1 dist 6.44266 10.1431 9.07452 7.28382 8.30714 16.1753 numMergedOcc 0
46 mol 285 unq 0 iso 0 dist 7.97209 14.0446 8.63954 8.87471 6.29045 5.52409 numMergedOcc 0
47 mol 285 unq 0 iso 1 dist 8.63954 14.0446 7.97209 5.52409 6.29045 8.87471 numMergedOcc 0
