0 mol 10 unq 0 iso 0 dist 9.6309 11.8229 9.9373 9.23414 3.3748 7.83087 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 9.6309 6.16158 8.4881 9.23414 3.3748 9.37129 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 8.76873 13.3283 9.9373 10.0775 3.3748 7.83087 numMergedOcc 0
3 mol 10 unq 3 iso 0 dist 8.76873 3.9468 8.4881 10.0775 3.3748 9.37129 numMergedOcc 0
4 mol 10 unq 4 iso 0 dist 9.58981 11.5823 9.9373 11.2253 3.3748 7.83087 numMergedOcc 0
5 mol 10 unq 5 iso 0 dist 9.58981 4.18003 8.4881 11.2253 3.3748 9.37129 numMergedOcc 0
6 mol 10 unq 6 iso 0 dist 9.23414 11.8229 7.83087 9.6309 3.3748 9.9373 numMergedOcc 0
7 mol 10 unq 7 iso 0 dist 9.23414 6.16158 9.37129 9.6309 3.3748 8.4881 numMergedOcc 0
8 mol 10 unq 8 iso 0 dist 8.44792 9.23608 5.8369 16.1947 8.53083 9.6451 numMergedOcc 0
9 mol 10 unq 9 iso 0 dist 8.44792 11.8998 8.06428 16.1947 8.53083 7.55253 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 5.10693 4.1947 8.24402 6.13459 10.7776 7.14241 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 6.13459 4.1947 7.14241 5.10693 10.7776 8.24402 numMergedOcc 0
12 mol 168 unq 0 iso 0 dist 8.97414 4.65845 5.64732 10.1297 6.37254 5.52214 numMergedOcc 0
13 mol 168 unq 1 iso 0 dist 8.97414 4.65845 5.64732 8.00063 8.38976 5.80055 numMergedOcc 0
14 mol 168 unq 2 iso 0 dist 8.97414 4.65845 5.64732 10.8516 8.62142 7.44481 numMergedOcc 0
15 mol 168 unq 3 iso 0 dist 8.00063 4.65845 5.80055 8.97414 8.38976 5.64732 numMergedOcc 0
16 mol 168 unq 4 iso 0 dist 8.00063 4.65845 5.80055 10.1297 6.81049 5.52214 numMergedOcc 0
17 mol 168 unq 5 iso 0 dist 8.00063 4.65845 5.80055 10.8516 3.44823 7.44481 numMergedOcc 0
18 mol 176 unq 0 iso 0 dist 9.09554 8.80566 8.0255 10.8313 6.34877 9.84239 numMergedOcc 0
19 mol 176 unq 1 iso 0 dist 9.09554 8.80566 8.0255 11.6003 3.47516 9.1728 numMergedOcc 0
20 mol 205 unq 0 iso 0 dist 8.25174 11.1756 9.95859 14.3507 13.0936 4.93303 numMergedOcc 0
21 mol 205 unq 1 iso 0 dist 9.16671 6.67537 9.95859 10.0133 13.0936 4.93303 numMergedOcc 0
22 mol 244 unq 0 iso 0 dist 5.16859 8.49995 9.07512 13.0697 11.6206 9.45199 numMergedOcc 0
23 mol 254 unq 0 iso 0 dist 9.09568 5.53022 9.672 9.99168 2.67738 9.15233 numMergedOcc 0
24 mol 254 unq 1 iso 0 dist 9.99168 5.53022 9.15233 9.09568 2.67738 9.672 numMergedOcc 0
25 mol 254 unq 2 iso 0 dist 7.84221 9.29698 9.672 9.67383 2.67738 9.15233 numMergedOcc 0
26 mol 254 unq 3 iso 0 dist 9.67383 9.29698 9.15233 7.84221 2.67738 9.672 numMergedOcc 0
27 mol 277 unq 0 iso 0 dist 8.72101 8.45252 8.90967 8.75619 3.75238 6.40861 numMergedOcc 0
28 mol 277 unq 1 iso 0 dist 8.75619 8.45252 6.40861 8.72101 3.75238 8.90967 numMergedOcc 0
29 mol 277 unq 2 iso 0 dist 5.11998 12.1971 8.90967 5.79925 3.75238 6.40861 numMergedOcc 0
30 mol 277 unq 3 iso 0 dist 5.79925 12.1971 6.40861 5.11998 3.75238 8.90967 numMergedOcc 0
31 mol 277 unq 4 iso 0 dist 8.55906 8.18751 6.40861 11.3414 3.75238 8.90967 numMergedOcc 0
32 mol 277 unq 5 iso 0 dist 5.55523 6.94318 6.40861 8.87837 3.75238 8.90967 numMergedOcc 0
33 mol 281 unq 0 iso 0 dist 9.13909 8.64726 6.62682 11.9913 3.77058 9.06888 numMergedOcc 0
34 mol 281 unq 1 iso 0 dist 6.82918 4.19307 9.06888 4.29351 3.77058 6.62682 numMergedOcc 0
35 mol 281 unq 2 iso 0 dist 4.29351 4.19307 6.62682 6.82918 3.77058 9.06888 numMergedOcc 0
36 mol 287 unq 0 iso 0 dist 9.40443 13.9608 7.82157 16.9176 13.001 8.39976 numMergedOcc 0
37 mol 287 unq 1 iso 0 dist 9.59195 8.74583 8.39976 16.4384 13.001 7.82157 numMergedOcc 0
38 mol 288 unq 0 iso 0 dist 9.40443 13.9608 7.82157 16.9176 13.001 8.39976 numMergedOcc 0
39 mol 288 unq 1 iso 0 dist 9.59195 8.74583 8.39976 16.4384 13.001 7.82157 numMergedOcc 0
40 mol 289 unq 0 iso 0 dist 9.40443 13.9608 7.82157 16.9176 13.001 8.39976 numMergedOcc 0
41 mol 289 unq 1 iso 0 dist 9.59195 8.74583 8.39976 16.4384 13.001 7.82157 numMergedOcc 0
