0 mol 10 unq 0 iso 0 dist 9.6309 4.96625 8.76873 11.8229 9.9373 13.3283 numMergedOcc 0
1 mol 10 unq 0 iso 1 dist 8.76873 4.96625 9.6309 13.3283 9.9373 11.8229 numMergedOcc 0
2 mol 10 unq 1 iso 0 dist 9.6309 4.96625 8.76873 6.16158 8.4881 3.9468 numMergedOcc 0
3 mol 10 unq 1 iso 1 dist 8.76873 4.96625 9.6309 3.9468 8.4881 6.16158 numMergedOcc 0
4 mol 10 unq 2 iso 0 dist 9.6309 10.304 9.58981 11.8229 9.9373 11.5823 numMergedOcc 0
5 mol 10 unq 2 iso 1 dist 9.58981 10.304 9.6309 11.5823 9.9373 11.8229 numMergedOcc 0
6 mol 10 unq 3 iso 0 dist 9.6309 10.304 9.58981 6.16158 8.4881 4.18003 numMergedOcc 0
7 mol 10 unq 3 iso 1 dist 9.58981 10.304 9.6309 4.18003 8.4881 6.16158 numMergedOcc 0
8 mol 10 unq 2 iso 0 dist 8.76873 7.00368 9.58981 13.3283 9.9373 11.5823 numMergedOcc 0
9 mol 10 unq 2 iso 1 dist 9.58981 7.00368 8.76873 11.5823 9.9373 13.3283 numMergedOcc 0
10 mol 10 unq 3 iso 0 dist 8.76873 7.00368 9.58981 3.9468 8.4881 4.18003 numMergedOcc 0
11 mol 10 unq 3 iso 1 dist 9.58981 7.00368 8.76873 4.18003 8.4881 3.9468 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 7.29864 12.0142 6.04223 14.7098 9.60046 4.40127 numMergedOcc 0
13 mol 92 unq 0 iso 1 dist 6.04223 12.0142 7.29864 4.40127 9.60046 14.7098 numMergedOcc 0
14 mol 183 unq 0 iso 0 dist 6.2675 3.75614 9.52042 3.94874 8.69656 4.44329 numMergedOcc 0
15 mol 183 unq 0 iso 1 dist 9.52042 3.75614 6.2675 4.44329 8.69656 3.94874 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 8.25174 5.24814 9.16671 11.1756 9.95859 6.67537 numMergedOcc 0
17 mol 205 unq 0 iso 1 dist 9.16671 5.24814 8.25174 6.67537 9.95859 11.1756 numMergedOcc 0
18 mol 232 unq 0 iso 0 dist 9.4726 15.8224 8.32831 11.8349 5.86945 4.44276 numMergedOcc 0
19 mol 232 unq 0 iso 1 dist 8.32831 15.8224 9.4726 4.44276 5.86945 11.8349 numMergedOcc 0
20 mol 232 unq 1 iso 0 dist 9.4726 12.5171 7.91213 11.8349 5.86945 4.31175 numMergedOcc 0
21 mol 232 unq 1 iso 1 dist 7.91213 12.5171 9.4726 4.31175 5.86945 11.8349 numMergedOcc 0
22 mol 232 unq 2 iso 0 dist 9.4726 9.9868 9.33969 11.8349 5.86945 9.07946 numMergedOcc 0
23 mol 232 unq 2 iso 1 dist 9.33969 9.9868 9.4726 9.07946 5.86945 11.8349 numMergedOcc 0
24 mol 232 unq 1 iso 0 dist 8.32831 5.14994 7.91213 4.44276 5.86945 4.31175 numMergedOcc 0
25 mol 232 unq 1 iso 1 dist 7.91213 5.14994 8.32831 4.31175 5.86945 4.44276 numMergedOcc 0
26 mol 232 unq 2 iso 0 dist 8.32831 10.8055 9.33969 4.44276 5.86945 9.07946 numMergedOcc 0
27 mol 232 unq 2 iso 1 dist 9.33969 10.8055 8.32831 9.07946 5.86945 4.44276 numMergedOcc 0
28 mol 232 unq 2 iso 0 dist 7.91213 6.05049 9.33969 4.31175 5.86945 9.07946 numMergedOcc 0
29 mol 232 unq 2 iso 1 dist 9.33969 6.05049 7.91213 9.07946 5.86945 4.31175 numMergedOcc 0
30 mol 254 unq 0 iso 0 dist 9.09568 7.04018 7.84221 5.53022 9.672 9.29698 numMergedOcc 0
31 mol 254 unq 0 iso 1 dist 7.84221 7.04018 9.09568 9.29698 9.672 5.53022 numMergedOcc 0
32 mol 254 unq 1 iso 0 dist 9.99168 7.04018 9.67383 5.53022 9.15233 9.29698 numMergedOcc 0
33 mol 254 unq 1 iso 1 dist 9.67383 7.04018 9.99168 9.29698 9.15233 5.53022 numMergedOcc 0
34 mol 266 unq 0 iso 0 dist 9.35293 3.47783 7.93375 11.141 7.74133 12.1796 numMergedOcc 0
35 mol 266 unq 0 iso 1 dist 7.93375 3.47783 9.35293 12.1796 7.74133 11.141 numMergedOcc 0
36 mol 269 unq 0 iso 0 dist 6.72096 9.73015 9.18157 10.1928 9.20068 16.128 numMergedOcc 0
37 mol 269 unq 0 iso 1 dist 9.18157 9.73015 6.72096 16.128 9.20068 10.1928 numMergedOcc 0
38 mol 277 unq 0 iso 0 dist 8.72101 12.609 5.11998 13.3688 9.07744 12.5633 numMergedOcc 0
39 mol 277 unq 0 iso 1 dist 5.11998 12.609 8.72101 12.5633 9.07744 13.3688 numMergedOcc 0
40 mol 277 unq 1 iso 0 dist 8.72101 12.609 5.11998 16.9673 8.42892 5.10572 numMergedOcc 0
41 mol 277 unq 1 iso 1 dist 5.11998 12.609 8.72101 5.10572 8.42892 16.9673 numMergedOcc 0
42 mol 277 unq 2 iso 0 dist 8.72101 12.609 5.11998 8.45252 8.90967 12.1971 numMergedOcc 0
43 mol 277 unq 2 iso 1 dist 5.11998 12.609 8.72101 12.1971 8.90967 8.45252 numMergedOcc 0
44 mol 277 unq 3 iso 0 dist 8.75619 12.609 5.79925 8.45252 6.40861 12.1971 numMergedOcc 0
45 mol 277 unq 3 iso 1 dist 5.79925 12.609 8.75619 12.1971 6.40861 8.45252 numMergedOcc 0
46 mol 277 unq 4 iso 0 dist 8.75619 15.6996 8.55906 8.45252 6.40861 8.18751 numMergedOcc 0
47 mol 277 unq 4 iso 1 dist 8.55906 15.6996 8.75619 8.18751 6.40861 8.45252 numMergedOcc 0
48 mol 277 unq 5 iso 0 dist 8.75619 9.36807 5.55523 8.45252 6.40861 6.94318 numMergedOcc 0
49 mol 277 unq 5 iso 1 dist 5.55523 9.36807 8.75619 6.94318 6.40861 8.45252 numMergedOcc 0
50 mol 277 unq 4 iso 0 dist 5.79925 11.9501 8.55906 12.1971 6.40861 8.18751 numMergedOcc 0
51 mol 277 unq 4 iso 1 dist 8.55906 11.9501 5.79925 8.18751 6.40861 12.1971 numMergedOcc 0
52 mol 277 unq 5 iso 0 dist 5.79925 9.40918 5.55523 12.1971 6.40861 6.94318 numMergedOcc 0
53 mol 277 unq 5 iso 1 dist 5.55523 9.40918 5.79925 6.94318 6.40861 12.1971 numMergedOcc 0
54 mol 277 unq 5 iso 0 dist 8.55906 9.84246 5.55523 8.18751 6.40861 6.94318 numMergedOcc 0
55 mol 277 unq 5 iso 1 dist 5.55523 9.84246 8.55906 6.94318 6.40861 8.18751 numMergedOcc 0
56 mol 281 unq 0 iso 0 dist 9.13909 10.3921 4.29351 8.64726 6.62682 4.19307 numMergedOcc 0
57 mol 281 unq 0 iso 1 dist 4.29351 10.3921 9.13909 4.19307 6.62682 8.64726 numMergedOcc 0
