0 mol 21 unq 0 iso 0 dist 9.63221 12.8031 5.0018 6.62981 7.39438 9.3814 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.03041 6.74888 7.84552 14.4605 8.80127 14.959 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.03041 6.74888 7.84552 4.42703 6.48457 9.85198 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 4.44406 12.4205 9.36759 8.14351 9.07906 14.6904 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 4.44406 12.4205 9.36759 6.15906 8.75567 12.0121 numMergedOcc 0
5 mol 43 unq 2 iso 0 dist 4.44406 5.71606 5.0553 8.14351 9.07906 11.8429 numMergedOcc 0
6 mol 43 unq 3 iso 0 dist 4.44406 5.71606 5.0553 6.15906 8.75567 5.8542 numMergedOcc 0
7 mol 107 unq 0 iso 0 dist 9.24821 13.8568 6.99676 5.07513 7.02709 13.5052 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 9.61323 9.94763 7.34368 5.05588 8.82676 10.345 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 9.61323 9.94763 7.34368 6.55771 8.17522 12.9049 numMergedOcc 0
10 mol 127 unq 2 iso 0 dist 9.61323 9.94763 7.34368 9.04558 8.14341 12.7518 numMergedOcc 0
11 mol 127 unq 3 iso 0 dist 9.61323 9.94763 7.34368 10.6795 6.54744 4.87509 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 4.58432 12.6755 9.87656 8.41711 8.86966 14.7987 numMergedOcc 0
13 mol 152 unq 1 iso 0 dist 4.58432 12.6755 9.87656 4.82496 5.7527 10.8051 numMergedOcc 0
14 mol 152 unq 2 iso 0 dist 4.58432 5.60671 5.35463 8.41711 8.86966 11.7248 numMergedOcc 0
15 mol 152 unq 3 iso 0 dist 4.58432 5.60671 5.35463 4.82496 5.7527 6.4987 numMergedOcc 0
16 mol 158 unq 0 iso 0 dist 6.9987 8.85571 7.41387 8.71298 9.53821 4.80775 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 7.82123 11.2457 5.35691 6.40443 8.91445 9.43043 numMergedOcc 0
18 mol 210 unq 0 iso 0 dist 8.34886 8.57866 8.86708 7.40381 5.62219 7.52343 numMergedOcc 0
19 mol 210 unq 1 iso 0 dist 8.34886 5.86194 5.86875 7.40381 5.62219 8.99603 numMergedOcc 0
20 mol 243 unq 0 iso 0 dist 5.7554 4.7112 7.43688 4.51966 9.57009 5.70085 numMergedOcc 0
21 mol 243 unq 1 iso 0 dist 5.7554 9.56957 5.50716 4.51966 9.57009 11.7956 numMergedOcc 0
22 mol 243 unq 2 iso 0 dist 7.3738 8.85604 7.43688 6.69562 9.57009 5.70085 numMergedOcc 0
23 mol 243 unq 3 iso 0 dist 7.3738 6.36228 5.50716 6.69562 9.57009 11.7956 numMergedOcc 0
24 mol 261 unq 0 iso 0 dist 6.85252 5.93392 7.01147 12.641 9.00426 13.3285 numMergedOcc 0
25 mol 261 unq 1 iso 0 dist 6.85252 4.20527 8.69549 12.641 9.00426 15.0037 numMergedOcc 0
26 mol 281 unq 0 iso 0 dist 9.27648 7.91952 5.46236 4.77509 6.49441 5.81338 numMergedOcc 0
27 mol 282 unq 0 iso 0 dist 6.93453 12.759 8.64115 4.59315 8.76788 14.9374 numMergedOcc 0
