0 mol 32 unq 0 iso 0 dist 8.70934 6.78305 9.65897 10.1217 7.70136 9.16481 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 6.35945 6.53804 8.74576 13.1419 11.3911 8.33273 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 6.57908 9.79566 7.79336 16.049 15.2801 8.87762 numMergedOcc 0
3 mol 34 unq 1 iso 0 dist 6.57908 8.89606 7.08559 16.049 15.2801 8.21762 numMergedOcc 0
4 mol 53 unq 0 iso 0 dist 9.60499 12.858 7.58093 19.1971 15.2861 9.06787 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 8.22048 15.1001 8.35444 16.4962 9.82767 5.14123 numMergedOcc 0
6 mol 59 unq 1 iso 0 dist 4.93077 4.80894 8.35444 6.61052 9.82767 5.14123 numMergedOcc 0
7 mol 62 unq 0 iso 0 dist 8.91572 8.91835 9.1062 9.36203 7.29999 5.6359 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 9.23448 6.98797 4.26972 6.75212 5.93604 6.31404 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 5.83972 6.98797 7.54341 6.75212 6.50711 6.31404 numMergedOcc 0
10 mol 144 unq 0 iso 0 dist 9.54955 8.35821 9.09684 13.9675 15.8553 8.85737 numMergedOcc 0
11 mol 144 unq 1 iso 0 dist 8.98299 4.9743 9.09684 12.6414 15.8553 8.85737 numMergedOcc 0
12 mol 225 unq 0 iso 0 dist 7.29635 14.2324 8.91356 11.4518 6.299 6.20862 numMergedOcc 0
13 mol 225 unq 1 iso 0 dist 7.29635 14.2324 8.91356 19.4411 13.7014 7.27888 numMergedOcc 0
14 mol 225 unq 2 iso 0 dist 8.23463 6.38826 9.59574 10.5126 9.63082 6.20862 numMergedOcc 0
15 mol 225 unq 3 iso 0 dist 8.23463 6.38826 9.59574 10.0725 13.9767 7.27888 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 9.13657 8.26863 6.01775 14.9139 6.99665 7.86214 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 9.13657 8.26863 6.01775 10.8857 4.43794 5.29501 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 9.13657 8.26863 6.01775 15.9428 11.2489 8.81206 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 9.19369 13.7396 6.23661 13.3472 11.4659 9.93282 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 9.99897 9.36666 8.59762 18.729 13.7013 9.51394 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 9.99897 9.36666 8.59762 18.729 13.7013 9.51394 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 9.99897 9.36666 8.59762 18.729 13.7013 9.51394 numMergedOcc 0
