0 mol 11 unq 0 iso 0 dist 9.76233 9.0553 7.85585 4.54527 9.07476 11.682 numMergedOcc 0
1 mol 62 unq 0 iso 0 dist 5.23167 9.8831 9.75794 8.02816 7.25138 14.8363 numMergedOcc 0
2 mol 62 unq 1 iso 0 dist 7.47607 14.1599 9.75794 5.07643 7.25138 14.8363 numMergedOcc 0
3 mol 68 unq 0 iso 0 dist 6.82511 8.3635 8.06999 3.95228 5.57551 10.7186 numMergedOcc 0
4 mol 103 unq 0 iso 0 dist 7.91691 9.13405 9.3508 3.97596 8.60172 5.57703 numMergedOcc 0
5 mol 113 unq 0 iso 0 dist 9.27028 12.8658 9.72242 16.1275 7.08403 13.1071 numMergedOcc 0
6 mol 113 unq 1 iso 0 dist 6.38269 14.0332 8.28997 12.0115 7.96893 10.8873 numMergedOcc 0
7 mol 113 unq 2 iso 0 dist 6.38269 5.30186 7.98399 12.0115 7.96893 9.36148 numMergedOcc 0
8 mol 169 unq 0 iso 0 dist 6.18165 13.5288 7.5669 9.58263 7.78577 9.19866 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.19926 4.86897 6.99201 11.641 9.14525 9.38036 numMergedOcc 0
10 mol 253 unq 0 iso 0 dist 8.34984 9.51713 8.15394 7.48068 8.71119 4.92131 numMergedOcc 0
11 mol 277 unq 0 iso 0 dist 7.34927 12.6113 5.99705 9.49228 8.72101 13.6326 numMergedOcc 0
12 mol 277 unq 1 iso 0 dist 7.34927 12.6113 5.99705 11.7966 5.11998 4.82882 numMergedOcc 0
13 mol 277 unq 2 iso 0 dist 7.54315 6.67537 5.99705 16.1206 8.72101 13.6326 numMergedOcc 0
14 mol 277 unq 3 iso 0 dist 7.54315 6.67537 5.99705 7.00586 5.11998 4.82882 numMergedOcc 0
15 mol 277 unq 4 iso 0 dist 7.88615 11.2676 5.04543 10.5169 8.75619 13.6326 numMergedOcc 0
16 mol 277 unq 5 iso 0 dist 7.88615 11.2676 5.04543 12.8601 5.79925 4.82882 numMergedOcc 0
17 mol 277 unq 6 iso 0 dist 7.88615 11.2676 5.04543 8.85294 8.55906 7.5495 numMergedOcc 0
18 mol 277 unq 7 iso 0 dist 7.88615 11.2676 5.04543 4.2416 5.55523 9.16695 numMergedOcc 0
19 mol 277 unq 8 iso 0 dist 7.88615 9.5513 8.99501 10.5169 8.75619 17.0068 numMergedOcc 0
20 mol 277 unq 9 iso 0 dist 7.88615 9.5513 8.99501 12.8601 5.79925 10.4709 numMergedOcc 0
21 mol 277 unq 10 iso 0 dist 7.88615 9.5513 8.99501 8.85294 8.55906 5.08958 numMergedOcc 0
22 mol 277 unq 11 iso 0 dist 7.88615 9.5513 8.99501 4.2416 5.55523 9.02911 numMergedOcc 0
23 mol 281 unq 0 iso 0 dist 8.78416 15.998 7.55248 6.85714 6.82918 13.9262 numMergedOcc 0
24 mol 281 unq 1 iso 0 dist 8.78416 14.6043 6.50041 6.85714 6.82918 9.83564 numMergedOcc 0
25 mol 281 unq 2 iso 0 dist 9.22428 14.6043 5.70591 16.6962 9.13909 8.53439 numMergedOcc 0
26 mol 281 unq 3 iso 0 dist 9.22428 14.6043 5.70591 6.85714 4.29351 9.83564 numMergedOcc 0
27 mol 281 unq 4 iso 0 dist 7.82358 10.4821 7.55248 12.3603 6.82918 13.9262 numMergedOcc 0
28 mol 281 unq 5 iso 0 dist 7.82358 13.3588 6.50041 12.3603 6.82918 9.83564 numMergedOcc 0
29 mol 281 unq 6 iso 0 dist 7.95687 11.9822 5.70591 9.0331 9.13909 8.53439 numMergedOcc 0
30 mol 281 unq 7 iso 0 dist 7.95687 11.9822 5.70591 5.28494 4.29351 9.83564 numMergedOcc 0
