0 mol 32 unq 0 iso 0 dist 6.35945 6.53804 8.74576 13.1419 11.3911 8.33273 10.12 6.68431 7.26268 5.27705 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 6.57908 9.79566 7.79336 16.049 15.2801 8.87762 11.1344 5.32981 7.18022 12.9926 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 6.57908 8.89606 7.08559 16.049 15.2801 8.21762 11.1344 5.32981 6.24711 12.9926 numMergedOcc 0
3 mol 53 unq 0 iso 0 dist 9.60499 12.858 7.58093 19.1971 15.2861 9.06787 16.2667 10.8486 7.28228 5.87231 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 8.91572 8.91835 9.1062 9.36203 7.29999 5.6359 17.0398 11.7069 9.69044 11.4221 numMergedOcc 0
5 mol 62 unq 1 iso 0 dist 8.91572 8.91835 9.1062 9.36203 7.29999 5.6359 11.295 5.49555 6.9103 4.05764 numMergedOcc 0
6 mol 144 unq 0 iso 0 dist 9.54955 8.35821 9.09684 13.9675 15.8553 8.85737 9.73668 10.4074 7.64028 7.12825 numMergedOcc 0
7 mol 144 unq 1 iso 0 dist 8.98299 4.9743 9.09684 12.6414 15.8553 8.85737 10.0633 10.4074 7.64028 7.12825 numMergedOcc 0
8 mol 225 unq 0 iso 0 dist 7.29635 14.2324 8.91356 11.4518 6.299 6.20862 14.3384 10.7506 8.1945 4.72643 numMergedOcc 0
9 mol 225 unq 1 iso 0 dist 7.29635 14.2324 8.91356 11.4518 6.299 6.20862 15.1958 8.69249 6.50998 9.6289 numMergedOcc 0
10 mol 225 unq 2 iso 0 dist 7.29635 14.2324 8.91356 19.4411 13.7014 7.27888 14.3384 10.7506 8.1945 15.1562 numMergedOcc 0
11 mol 225 unq 3 iso 0 dist 7.29635 14.2324 8.91356 19.4411 13.7014 7.27888 15.1958 8.69249 6.50998 5.92569 numMergedOcc 0
12 mol 225 unq 4 iso 0 dist 8.23463 6.38826 9.59574 10.5126 9.63082 6.20862 9.30186 7.12954 8.1945 4.72643 numMergedOcc 0
13 mol 225 unq 5 iso 0 dist 8.23463 6.38826 9.59574 10.5126 9.63082 6.20862 12.2976 14.2819 6.50998 9.6289 numMergedOcc 0
14 mol 225 unq 6 iso 0 dist 8.23463 6.38826 9.59574 10.0725 13.9767 7.27888 9.30186 7.12954 8.1945 15.1562 numMergedOcc 0
15 mol 225 unq 7 iso 0 dist 8.23463 6.38826 9.59574 10.0725 13.9767 7.27888 12.2976 14.2819 6.50998 5.92569 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 9.13657 8.26863 6.01775 14.9139 6.99665 7.86214 12.4566 8.96098 8.51625 10.8561 numMergedOcc 0
17 mol 233 unq 1 iso 0 dist 9.13657 8.26863 6.01775 10.8857 4.43794 5.29501 12.4566 8.96098 8.51625 5.19558 numMergedOcc 0
18 mol 233 unq 2 iso 0 dist 9.13657 8.26863 6.01775 15.9428 11.2489 8.81206 12.4566 8.96098 8.51625 6.48373 numMergedOcc 0
19 mol 259 unq 0 iso 0 dist 9.19369 13.7396 6.23661 13.3472 11.4659 9.93282 9.89728 5.79468 5.85442 5.69584 numMergedOcc 0
20 mol 259 unq 1 iso 0 dist 9.19369 13.7396 6.23661 13.3472 11.4659 9.93282 14.0886 5.31048 6.9899 15.3167 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 9.99897 9.36666 8.59762 18.729 13.7013 9.51394 14.6115 7.23534 7.45616 6.89449 numMergedOcc 0
22 mol 288 unq 0 iso 0 dist 9.99897 9.36666 8.59762 18.729 13.7013 9.51394 14.6115 7.23534 7.45616 6.89449 numMergedOcc 0
23 mol 289 unq 0 iso 0 dist 9.99897 9.36666 8.59762 18.729 13.7013 9.51394 14.6115 7.23534 7.45616 6.89449 numMergedOcc 0
