0 mol 16 unq 0 iso 0 dist 6.61114 6.75381 10.1658 6.50294 4.86568 10.977 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.04965 6.32791 9.99279 5.8404 4.86568 11.061 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 6.32791 6.04965 9.99279 5.28404 4.7319 10.977 numMergedOcc 0
3 mol 16 unq 3 iso 0 dist 6.75381 6.61114 10.1658 5.50193 4.7319 11.061 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 9.07927 9.27448 6.23352 6.44262 7.31767 11.0377 numMergedOcc 0
5 mol 25 unq 1 iso 0 dist 9.07927 8.50987 4.51512 6.44262 7.31767 6.03987 numMergedOcc 0
6 mol 25 unq 2 iso 0 dist 8.50987 9.27448 9.85159 6.44262 6.03987 11.0377 numMergedOcc 0
7 mol 25 unq 3 iso 0 dist 8.50987 9.07927 4.51512 6.44262 6.03987 7.31767 numMergedOcc 0
8 mol 45 unq 0 iso 0 dist 9.73896 6.96797 5.24762 5.84852 6.43774 7.2846 numMergedOcc 0
9 mol 45 unq 1 iso 0 dist 6.96797 9.73896 5.24762 5.84852 7.2846 6.43774 numMergedOcc 0
10 mol 45 unq 2 iso 0 dist 6.96797 9.73896 5.24762 6.5822 7.58835 11.2563 numMergedOcc 0
11 mol 101 unq 0 iso 0 dist 7.42893 8.23251 8.13019 5.81947 6.57035 12.0459 numMergedOcc 0
12 mol 102 unq 0 iso 0 dist 5.79411 9.9404 5.49089 6.03768 7.36792 12.8376 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 6.61066 6.3982 10.4152 6.06993 4.99221 11.2489 numMergedOcc 0
14 mol 115 unq 1 iso 0 dist 6.3982 6.61066 10.4152 5.29965 5.11551 11.5333 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 8.31743 8.5778 5.79898 10.2414 9.89303 6.54501 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 8.5778 8.31743 5.79898 10.2414 6.54501 9.89303 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 8.5778 8.31743 5.79898 13.5276 6.49416 9.93925 numMergedOcc 0
18 mol 229 unq 0 iso 0 dist 9.68636 7.81415 6.84129 10.705 8.22528 13.2905 numMergedOcc 0
19 mol 229 unq 1 iso 0 dist 9.68636 7.81415 6.84129 5.6419 7.03423 9.06952 numMergedOcc 0
20 mol 229 unq 2 iso 0 dist 7.81415 9.68636 6.84129 5.6419 9.06952 7.03423 numMergedOcc 0
21 mol 229 unq 3 iso 0 dist 9.67544 9.48923 5.46031 6.23286 9.87838 10.0037 numMergedOcc 0
22 mol 234 unq 0 iso 0 dist 8.58958 7.17987 5.88703 16.0172 8.34494 12.9605 numMergedOcc 0
23 mol 234 unq 1 iso 0 dist 8.58958 7.17987 5.88703 14.7629 6.56247 9.45496 numMergedOcc 0
24 mol 234 unq 2 iso 0 dist 8.58958 7.17987 5.88703 13.5847 9.36357 6.7625 numMergedOcc 0
25 mol 234 unq 3 iso 0 dist 7.17987 8.58958 5.88703 14.7629 9.45496 6.56247 numMergedOcc 0
26 mol 234 unq 4 iso 0 dist 7.17987 8.58958 5.88703 13.5847 6.7625 9.36357 numMergedOcc 0
27 mol 236 unq 0 iso 0 dist 6.67907 6.0087 7.43758 5.81354 8.04248 8.35971 numMergedOcc 0
28 mol 236 unq 1 iso 0 dist 6.0087 6.67907 7.43758 11.2678 8.03456 15.1853 numMergedOcc 0
29 mol 236 unq 2 iso 0 dist 6.0087 6.67907 7.43758 12.338 6.84306 13.5269 numMergedOcc 0
30 mol 236 unq 3 iso 0 dist 6.0087 6.67907 7.43758 12.431 9.99038 15.7308 numMergedOcc 0
31 mol 236 unq 4 iso 0 dist 6.0087 6.67907 7.43758 8.71933 9.78037 14.9122 numMergedOcc 0
32 mol 236 unq 5 iso 0 dist 6.0087 6.67907 7.43758 5.81354 8.35971 8.04248 numMergedOcc 0
33 mol 249 unq 0 iso 0 dist 9.14351 9.0157 8.34718 12.1004 7.57994 11.7594 numMergedOcc 0
34 mol 249 unq 1 iso 0 dist 9.14351 9.0157 8.34718 9.40115 6.18582 12.2913 numMergedOcc 0
35 mol 258 unq 0 iso 0 dist 9.80417 8.26503 10.7374 10.759 6.60405 14.3043 numMergedOcc 0
36 mol 259 unq 0 iso 0 dist 8.70852 9.89728 7.64658 5.07898 7.84554 7.46176 numMergedOcc 0
37 mol 259 unq 1 iso 0 dist 8.70852 6.42437 5.87173 5.07898 7.84554 9.18903 numMergedOcc 0
38 mol 259 unq 2 iso 0 dist 9.89728 8.70852 7.64658 5.07898 7.46176 7.84554 numMergedOcc 0
39 mol 259 unq 3 iso 0 dist 9.89728 6.42437 10.5239 5.07898 7.46176 9.18903 numMergedOcc 0
40 mol 259 unq 4 iso 0 dist 6.42437 8.70852 5.87173 5.07898 9.18903 7.84554 numMergedOcc 0
41 mol 259 unq 5 iso 0 dist 6.42437 9.89728 10.5239 5.07898 9.18903 7.46176 numMergedOcc 0
42 mol 264 unq 0 iso 0 dist 6.20796 8.43682 4.92077 6.9758 9.17653 13.4025 numMergedOcc 0
43 mol 277 unq 0 iso 0 dist 6.49176 8.23147 7.08227 14.4976 9.7748 16.3537 numMergedOcc 0
44 mol 278 unq 0 iso 0 dist 8.62414 6.23184 8.29447 12.2316 8.44326 10.6095 numMergedOcc 0
45 mol 292 unq 0 iso 0 dist 6.87804 6.02089 11.8061 11.634 8.2734 17.2013 numMergedOcc 0
