0 mol 34 unq 0 iso 0 dist 9.48195 5.3372 9.99939 6.17472 15.1968 6.87871 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 7.07773 4.30086 9.99939 11.0775 15.1968 6.87871 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 9.1568 6.31521 8.83233 12.3704 7.10133 9.23576 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 7.80117 9.69698 9.02471 8.58709 5.46849 9.74445 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 9.79386 5.90113 9.02471 7.53564 5.46849 9.74445 numMergedOcc 0
5 mol 68 unq 0 iso 0 dist 9.55023 12.9158 8.06267 19.3502 13.0721 9.93344 numMergedOcc 0
6 mol 68 unq 1 iso 0 dist 4.39888 6.13436 8.06267 13.6184 13.0721 9.93344 numMergedOcc 0
7 mol 68 unq 2 iso 0 dist 5.29595 6.13436 5.88334 13.6184 10.6791 9.93344 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 5.7576 5.33851 6.23522 8.40844 8.0072 9.68526 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 5.7576 5.33851 6.23522 6.99156 9.61302 9.72442 numMergedOcc 0
10 mol 102 unq 0 iso 0 dist 9.5434 5.09542 5.54256 7.73836 8.94532 9.01767 numMergedOcc 0
11 mol 102 unq 1 iso 0 dist 9.5434 5.09542 5.54256 10.8539 6.94341 9.80678 numMergedOcc 0
12 mol 122 unq 0 iso 0 dist 8.08737 7.21898 4.42563 12.1456 12.2092 8.33083 numMergedOcc 0
13 mol 124 unq 0 iso 0 dist 9.66083 12.0443 8.57739 12.8469 3.75669 9.91381 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 8.12319 5.25879 8.81797 8.26291 4.81304 8.54461 numMergedOcc 0
15 mol 130 unq 1 iso 0 dist 8.12319 10.9365 5.92733 8.26291 4.81304 7.83619 numMergedOcc 0
16 mol 130 unq 2 iso 0 dist 8.12319 10.9365 5.92733 17.9497 11.0219 9.91643 numMergedOcc 0
17 mol 130 unq 3 iso 0 dist 9.04366 10.7254 8.81797 7.86001 4.81304 8.54461 numMergedOcc 0
18 mol 130 unq 4 iso 0 dist 9.04366 5.63567 5.92733 7.86001 4.81304 7.83619 numMergedOcc 0
19 mol 130 unq 5 iso 0 dist 9.04366 5.63567 5.92733 13.5796 11.0219 9.91643 numMergedOcc 0
20 mol 131 unq 0 iso 0 dist 8.44004 5.29825 8.80895 5.50364 5.51548 8.97145 numMergedOcc 0
21 mol 131 unq 1 iso 0 dist 8.44004 5.29825 8.80895 8.7301 5.61122 6.5874 numMergedOcc 0
22 mol 175 unq 0 iso 0 dist 7.10869 12.5716 9.32259 16.3925 9.57126 9.57611 numMergedOcc 0
23 mol 175 unq 1 iso 0 dist 7.19751 9.72213 9.19156 8.39634 10.8953 9.00898 numMergedOcc 0
24 mol 213 unq 0 iso 0 dist 8.64187 10.3241 4.66576 10.2493 5.36904 4.58599 numMergedOcc 0
25 mol 213 unq 1 iso 0 dist 8.64187 10.3241 4.66576 10.2329 4.84414 8.78568 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 4.76819 5.20266 8.60731 4.46314 3.79439 8.68464 numMergedOcc 0
27 mol 239 unq 0 iso 0 dist 7.99963 4.77446 4.43499 4.21935 7.72768 6.37342 numMergedOcc 0
28 mol 257 unq 0 iso 0 dist 8.81508 6.64096 9.6834 10.7763 12.8843 5.36776 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 5.57978 10.4505 5.4557 14.9652 9.93118 5.81927 numMergedOcc 0
30 mol 265 unq 0 iso 0 dist 7.7096 11.263 8.54108 13.8245 13.876 9.59213 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 7.70811 7.26296 6.09853 15.7327 12.2802 9.02749 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 8.90108 7.64772 8.12739 14.7487 12.2201 9.02749 numMergedOcc 0
33 mol 274 unq 2 iso 0 dist 9.98144 7.64772 6.09853 14.7487 12.2802 9.02749 numMergedOcc 0
