0 mol 5 unq 0 iso 0 dist 9.22115 10.5355 8.88048 6.3891 6.77563 9.72215 numMergedOcc 0
1 mol 14 unq 0 iso 0 dist 8.32424 4.49598 9.42387 5.73967 6.30573 5.55214 numMergedOcc 0
2 mol 14 unq 1 iso 0 dist 8.32424 5.76472 7.59564 5.73967 6.30573 4.75873 numMergedOcc 0
3 mol 14 unq 2 iso 0 dist 8.32424 10.6449 8.10957 5.73967 6.30573 6.03847 numMergedOcc 0
4 mol 21 unq 0 iso 0 dist 9.19322 10.5082 8.07914 14.2892 8.85347 4.964 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 5.5483 4.09692 7.32913 6.15906 9.58938 4.92159 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 9.30432 10.8436 7.32913 9.3079 9.58938 4.92159 numMergedOcc 0
7 mol 64 unq 0 iso 0 dist 6.27017 5.04832 8.85416 4.23724 9.99634 6.43864 numMergedOcc 0
8 mol 71 unq 0 iso 0 dist 9.3877 12.1458 8.92529 13.394 8.21553 6.10737 numMergedOcc 0
9 mol 71 unq 1 iso 0 dist 9.3877 12.1458 8.92529 7.15395 8.22762 6.78097 numMergedOcc 0
10 mol 109 unq 0 iso 0 dist 9.4557 4.41675 8.53914 8.92081 7.4371 9.09837 numMergedOcc 0
11 mol 167 unq 0 iso 0 dist 7.04009 4.91302 7.20545 7.01116 8.58946 4.70374 numMergedOcc 0
12 mol 175 unq 0 iso 0 dist 6.79646 4.9282 7.03107 6.87887 6.6776 4.51101 numMergedOcc 0
13 mol 189 unq 0 iso 0 dist 9.40683 6.55569 6.38294 4.62521 8.57361 6.35993 numMergedOcc 0
14 mol 198 unq 0 iso 0 dist 8.73074 15.3415 9.87574 7.34126 7.24395 10.0277 numMergedOcc 0
15 mol 214 unq 0 iso 0 dist 7.74406 8.42395 5.86911 6.61663 9.4835 13.1789 numMergedOcc 0
16 mol 214 unq 1 iso 0 dist 7.74406 3.97644 7.89258 6.61663 9.4835 10.1543 numMergedOcc 0
17 mol 217 unq 0 iso 0 dist 8.29482 5.1774 7.60302 9.7524 9.90668 8.92136 numMergedOcc 0
18 mol 223 unq 0 iso 0 dist 9.10041 10.9692 6.97426 11.1577 9.94212 15.9255 numMergedOcc 0
19 mol 223 unq 1 iso 0 dist 9.10041 10.9692 6.97426 14.2827 7.34316 8.64175 numMergedOcc 0
20 mol 223 unq 2 iso 0 dist 9.10041 10.2498 8.87456 11.1577 9.94212 17.7343 numMergedOcc 0
21 mol 223 unq 3 iso 0 dist 9.10041 10.2498 8.87456 14.2827 7.34316 12.9895 numMergedOcc 0
22 mol 258 unq 0 iso 0 dist 8.88518 14.5913 8.10903 5.29393 9.67877 13.3533 numMergedOcc 0
23 mol 258 unq 1 iso 0 dist 8.88518 14.5913 8.10903 17.2521 8.81059 5.90131 numMergedOcc 0
24 mol 258 unq 2 iso 0 dist 8.88518 14.5913 8.10903 16.8571 9.12006 9.68064 numMergedOcc 0
25 mol 258 unq 3 iso 0 dist 8.88518 14.3641 7.25618 5.29393 9.67877 15.0574 numMergedOcc 0
26 mol 258 unq 4 iso 0 dist 8.88518 14.3641 7.25618 17.2521 8.81059 4.51422 numMergedOcc 0
27 mol 258 unq 5 iso 0 dist 8.88518 14.3641 7.25618 16.8571 9.12006 4.99997 numMergedOcc 0
28 mol 258 unq 6 iso 0 dist 9.44669 12.0868 9.48772 6.50764 8.55181 5.84297 numMergedOcc 0
29 mol 258 unq 7 iso 0 dist 9.44669 5.60485 5.53369 6.50764 8.55181 5.49492 numMergedOcc 0
30 mol 258 unq 8 iso 0 dist 9.44669 4.22701 8.57274 6.50764 8.55181 5.80854 numMergedOcc 0
31 mol 281 unq 0 iso 0 dist 8.88843 4.02168 7.65321 10.0614 9.65665 6.20237 numMergedOcc 0
32 mol 281 unq 1 iso 0 dist 9.13318 10.4623 6.58925 4.77509 9.48968 9.49279 numMergedOcc 0
33 mol 294 unq 0 iso 0 dist 9.23009 4.33731 9.22572 5.08625 8.52208 4.40208 numMergedOcc 0
