0 mol 21 unq 0 iso 0 dist 6.97295 4.81505 8.07914 4.47536 5.0018 3.91407 numMergedOcc 0
1 mol 56 unq 0 iso 0 dist 7.96214 13.6612 9.06142 9.09045 8.91502 9.93163 numMergedOcc 0
2 mol 56 unq 1 iso 0 dist 7.96214 11.9413 8.41264 9.09045 8.91502 4.5508 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.31934 8.773 9.11512 4.66383 8.22018 12.8904 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 6.31934 8.773 9.11512 12.456 8.31737 14.1477 numMergedOcc 0
5 mol 63 unq 0 iso 0 dist 6.57773 4.24825 7.44913 4.32938 9.93484 6.29544 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 5.22576 6.39764 8.91354 10.7477 9.00799 9.01897 numMergedOcc 0
7 mol 91 unq 1 iso 0 dist 5.22576 6.39764 8.91354 4.09058 6.29207 9.40413 numMergedOcc 0
8 mol 91 unq 2 iso 0 dist 8.65409 13.7719 8.91354 16.8301 9.00799 9.01897 numMergedOcc 0
9 mol 91 unq 3 iso 0 dist 8.65409 13.7719 8.91354 5.07611 6.29207 9.40413 numMergedOcc 0
10 mol 116 unq 0 iso 0 dist 7.53333 5.2815 6.90966 4.98469 8.81935 3.75089 numMergedOcc 0
11 mol 132 unq 0 iso 0 dist 8.97036 12.389 6.94745 5.31007 9.77766 12.0828 numMergedOcc 0
12 mol 132 unq 1 iso 0 dist 8.97036 12.389 6.94745 8.5728 9.11314 10.2787 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 6.17633 8.47619 9.18753 7.45956 8.21863 4.11931 numMergedOcc 0
14 mol 148 unq 1 iso 0 dist 9.32264 12.407 9.18753 10.4294 8.21863 4.11931 numMergedOcc 0
15 mol 150 unq 0 iso 0 dist 6.20295 8.33704 9.15244 7.31687 8.16324 4.16002 numMergedOcc 0
16 mol 150 unq 1 iso 0 dist 9.34249 12.3632 9.15244 10.3198 8.16324 4.16002 numMergedOcc 0
17 mol 182 unq 0 iso 0 dist 8.25297 9.56793 6.38335 11.1615 7.76901 8.70351 numMergedOcc 0
18 mol 182 unq 1 iso 0 dist 8.25297 9.56793 6.38335 11.7622 9.80892 6.2072 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 7.78385 4.62781 9.2254 12.4957 5.84716 14.6234 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 7.17789 10.2242 9.2254 10.6238 5.84716 14.6234 numMergedOcc 0
21 mol 186 unq 2 iso 0 dist 9.99051 7.68008 8.46819 4.23779 7.39604 8.8081 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 7.7874 5.43552 4.36421 6.37058 9.08316 9.70491 numMergedOcc 0
23 mol 233 unq 0 iso 0 dist 9.06221 4.67806 6.9103 3.988 9.11467 3.8054 numMergedOcc 0
24 mol 245 unq 0 iso 0 dist 5.70624 4.95438 9.96585 11.7123 9.99553 14.6353 numMergedOcc 0
25 mol 245 unq 1 iso 0 dist 5.70624 5.42329 7.27022 11.7123 9.99553 11.485 numMergedOcc 0
26 mol 245 unq 2 iso 0 dist 5.70624 12.1537 7.95061 11.7123 9.99553 12.8603 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 5.50553 11.0096 9.8165 6.84145 7.7033 9.45777 numMergedOcc 0
28 mol 266 unq 0 iso 0 dist 9.51286 8.13583 9.0836 11.735 9.27812 4.07542 numMergedOcc 0
29 mol 266 unq 1 iso 0 dist 9.51286 4.80695 9.62494 11.735 9.27812 8.72214 numMergedOcc 0
30 mol 281 unq 0 iso 0 dist 5.53313 4.48742 7.65321 6.22109 5.46236 8.82508 numMergedOcc 0
