0 mol 14 unq 0 iso 0 dist 8.32424 4.49598 9.42387 11.2259 5.91419 9.82883 numMergedOcc 0
1 mol 64 unq 0 iso 0 dist 7.14019 4.21513 6.3141 12.5262 7.20844 9.27697 numMergedOcc 0
2 mol 64 unq 1 iso 0 dist 8.86048 3.73708 6.3141 12.1848 7.20844 9.27697 numMergedOcc 0
3 mol 104 unq 0 iso 0 dist 5.46461 4.86912 5.71279 9.85189 5.78815 7.32917 numMergedOcc 0
4 mol 104 unq 1 iso 0 dist 5.46461 4.86912 5.71279 12.6823 10.2942 8.84844 numMergedOcc 0
5 mol 140 unq 0 iso 0 dist 8.72216 4.46614 7.60956 8.6371 5.00766 6.55217 numMergedOcc 0
6 mol 140 unq 1 iso 0 dist 8.72216 4.74205 9.9171 8.6371 5.00766 7.21686 numMergedOcc 0
7 mol 165 unq 0 iso 0 dist 8.19939 7.20315 7.21397 6.62466 6.27901 7.8052 numMergedOcc 0
8 mol 203 unq 0 iso 0 dist 9.44579 8.95399 6.84619 11.2336 4.51654 5.46529 numMergedOcc 0
9 mol 223 unq 0 iso 0 dist 9.10041 10.9692 6.97426 10.8742 4.68566 7.96628 numMergedOcc 0
10 mol 223 unq 1 iso 0 dist 9.10041 10.2498 8.87456 10.8742 4.68566 7.76053 numMergedOcc 0
11 mol 223 unq 2 iso 0 dist 9.10041 10.2498 8.87456 11.3928 11.1044 9.65728 numMergedOcc 0
12 mol 229 unq 0 iso 0 dist 9.79447 6.60289 6.28935 9.69083 6.40216 9.42877 numMergedOcc 0
13 mol 249 unq 0 iso 0 dist 9.19506 7.85269 3.67935 9.00613 6.13333 5.70674 numMergedOcc 0
14 mol 255 unq 0 iso 0 dist 5.84157 4.52659 7.57779 8.17286 12.1115 7.16286 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 8.88518 14.5913 8.10903 13.522 5.79358 8.73425 numMergedOcc 0
16 mol 258 unq 1 iso 0 dist 8.88518 14.3641 7.25618 13.522 5.79358 9.65711 numMergedOcc 0
17 mol 272 unq 0 iso 0 dist 8.85358 6.9955 5.37747 10.7317 6.62729 5.34803 numMergedOcc 0
18 mol 280 unq 0 iso 0 dist 7.60676 7.87626 4.45141 7.11605 5.846 6.38295 numMergedOcc 0
19 mol 281 unq 0 iso 0 dist 8.67922 7.84143 4.75349 12.9709 5.50235 6.47753 numMergedOcc 0
20 mol 281 unq 1 iso 0 dist 8.67922 7.84143 4.75349 16.7177 9.84433 9.69744 numMergedOcc 0
21 mol 287 unq 0 iso 0 dist 7.64715 5.71189 5.15923 14.8389 11.7624 9.30394 numMergedOcc 0
22 mol 287 unq 1 iso 0 dist 7.64715 5.71189 5.15923 11.1461 5.58788 5.84467 numMergedOcc 0
23 mol 287 unq 2 iso 0 dist 9.04355 5.05806 6.96774 8.72085 7.43524 9.84741 numMergedOcc 0
24 mol 287 unq 3 iso 0 dist 9.04355 11.1974 7.14859 16.3372 14.0575 8.5458 numMergedOcc 0
25 mol 287 unq 4 iso 0 dist 9.04355 11.1974 7.14859 11.9996 10.6005 8.56533 numMergedOcc 0
26 mol 287 unq 5 iso 0 dist 8.50508 8.049 5.15923 16.3372 11.7624 9.30394 numMergedOcc 0
27 mol 287 unq 6 iso 0 dist 8.50508 8.049 5.15923 11.9996 5.58788 5.84467 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 7.64715 5.71189 5.15923 14.8389 11.7624 9.30394 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 7.64715 5.71189 5.15923 11.1461 5.58788 5.84467 numMergedOcc 0
30 mol 288 unq 2 iso 0 dist 9.04355 5.05806 6.96774 8.72085 7.43524 9.84741 numMergedOcc 0
31 mol 288 unq 3 iso 0 dist 9.04355 11.1974 7.14859 16.3372 14.0575 8.5458 numMergedOcc 0
32 mol 288 unq 4 iso 0 dist 9.04355 11.1974 7.14859 11.9996 10.6005 8.56533 numMergedOcc 0
33 mol 288 unq 5 iso 0 dist 8.50508 8.049 5.15923 16.3372 11.7624 9.30394 numMergedOcc 0
34 mol 288 unq 6 iso 0 dist 8.50508 8.049 5.15923 11.9996 5.58788 5.84467 numMergedOcc 0
35 mol 289 unq 0 iso 0 dist 7.64715 5.71189 5.15923 14.8389 11.7624 9.30394 numMergedOcc 0
36 mol 289 unq 1 iso 0 dist 7.64715 5.71189 5.15923 11.1461 5.58788 5.84467 numMergedOcc 0
37 mol 289 unq 2 iso 0 dist 9.04355 5.05806 6.96774 8.72085 7.43524 9.84741 numMergedOcc 0
38 mol 289 unq 3 iso 0 dist 9.04355 11.1974 7.14859 16.3372 14.0575 8.5458 numMergedOcc 0
39 mol 289 unq 4 iso 0 dist 9.04355 11.1974 7.14859 11.9996 10.6005 8.56533 numMergedOcc 0
40 mol 289 unq 5 iso 0 dist 8.50508 8.049 5.15923 16.3372 11.7624 9.30394 numMergedOcc 0
41 mol 289 unq 6 iso 0 dist 8.50508 8.049 5.15923 11.9996 5.58788 5.84467 numMergedOcc 0
