0 mol 7 unq 0 iso 0 dist 9.90117 15.279 7.5298 11.7275 8.94874 13.8023 numMergedOcc 0
1 mol 7 unq 0 iso 1 dist 9.90117 11.7275 8.94874 15.279 7.5298 13.8023 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 7.58788 6.63489 5.62629 6.37473 6.15118 5.90603 numMergedOcc 0
3 mol 55 unq 0 iso 1 dist 7.58788 6.37473 6.15118 6.63489 5.62629 5.90603 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 5.39171 6.13631 7.84699 12.6081 7.53504 13.6926 numMergedOcc 0
5 mol 73 unq 0 iso 1 dist 5.39171 12.6081 7.53504 6.13631 7.84699 13.6926 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 9.27355 6.13631 8.40844 16.1129 7.02351 14.5875 numMergedOcc 0
7 mol 73 unq 1 iso 1 dist 9.27355 16.1129 7.02351 6.13631 8.40844 14.5875 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 9.27355 6.13631 8.40844 12.6081 8.66342 13.6926 numMergedOcc 0
9 mol 73 unq 2 iso 1 dist 9.27355 12.6081 8.66342 6.13631 8.40844 13.6926 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 9.27355 16.1129 7.02351 12.6081 8.66342 12.3241 numMergedOcc 0
11 mol 73 unq 2 iso 1 dist 9.27355 12.6081 8.66342 16.1129 7.02351 12.3241 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 8.60363 6.13631 6.99156 12.6081 7.21285 13.6926 numMergedOcc 0
13 mol 73 unq 3 iso 1 dist 8.60363 12.6081 7.21285 6.13631 6.99156 13.6926 numMergedOcc 0
14 mol 73 unq 4 iso 0 dist 9.27331 11.9439 6.99156 14.1204 7.21285 13.6926 numMergedOcc 0
15 mol 73 unq 4 iso 1 dist 9.27331 14.1204 7.21285 11.9439 6.99156 13.6926 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 9.89311 13.8587 8.21112 9.6353 7.06533 4.4482 numMergedOcc 0
17 mol 205 unq 0 iso 1 dist 9.89311 9.6353 7.06533 13.8587 8.21112 4.4482 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 9.89311 13.8587 8.21112 11.7852 5.94835 11.1418 numMergedOcc 0
19 mol 205 unq 1 iso 1 dist 9.89311 11.7852 5.94835 13.8587 8.21112 11.1418 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 9.89311 9.6353 7.06533 11.7852 5.94835 10.4273 numMergedOcc 0
21 mol 205 unq 1 iso 1 dist 9.89311 11.7852 5.94835 9.6353 7.06533 10.4273 numMergedOcc 0
22 mol 211 unq 0 iso 0 dist 9.8921 16.4954 9.45365 15.2751 7.15386 4.78922 numMergedOcc 0
23 mol 211 unq 0 iso 1 dist 9.8921 15.2751 7.15386 16.4954 9.45365 4.78922 numMergedOcc 0
24 mol 211 unq 1 iso 0 dist 9.8921 16.4954 9.45365 17.5039 7.73993 8.05917 numMergedOcc 0
25 mol 211 unq 1 iso 1 dist 9.8921 17.5039 7.73993 16.4954 9.45365 8.05917 numMergedOcc 0
26 mol 211 unq 1 iso 0 dist 9.8921 15.2751 7.15386 17.5039 7.73993 5.16245 numMergedOcc 0
27 mol 211 unq 1 iso 1 dist 9.8921 17.5039 7.73993 15.2751 7.15386 5.16245 numMergedOcc 0
28 mol 220 unq 0 iso 0 dist 8.94094 8.02012 7.80496 6.1155 8.75468 9.83283 numMergedOcc 0
29 mol 220 unq 0 iso 1 dist 8.94094 6.1155 8.75468 8.02012 7.80496 9.83283 numMergedOcc 0
30 mol 220 unq 1 iso 0 dist 8.94094 8.02012 7.80496 4.44269 8.60479 11.1254 numMergedOcc 0
31 mol 220 unq 1 iso 1 dist 8.94094 4.44269 8.60479 8.02012 7.80496 11.1254 numMergedOcc 0
32 mol 220 unq 1 iso 0 dist 8.94094 6.1155 8.75468 4.44269 8.60479 7.23892 numMergedOcc 0
33 mol 220 unq 1 iso 1 dist 8.94094 4.44269 8.60479 6.1155 8.75468 7.23892 numMergedOcc 0
34 mol 220 unq 2 iso 0 dist 9.17355 15.9642 7.96759 5.10907 8.94384 14.7376 numMergedOcc 0
35 mol 220 unq 2 iso 1 dist 9.17355 5.10907 8.94384 15.9642 7.96759 14.7376 numMergedOcc 0
36 mol 220 unq 3 iso 0 dist 8.5434 14.8023 7.96759 5.61953 8.94384 14.7376 numMergedOcc 0
37 mol 220 unq 3 iso 1 dist 8.5434 5.61953 8.94384 14.8023 7.96759 14.7376 numMergedOcc 0
38 mol 220 unq 4 iso 0 dist 7.20255 6.40358 5.51565 7.36665 9.74776 6.08531 numMergedOcc 0
39 mol 220 unq 4 iso 1 dist 7.20255 7.36665 9.74776 6.40358 5.51565 6.08531 numMergedOcc 0
40 mol 220 unq 5 iso 0 dist 9.35184 5.5295 7.80496 13.0157 8.75468 9.83283 numMergedOcc 0
41 mol 220 unq 5 iso 1 dist 9.35184 13.0157 8.75468 5.5295 7.80496 9.83283 numMergedOcc 0
42 mol 220 unq 6 iso 0 dist 9.35184 5.5295 7.80496 10.9011 8.60479 11.1254 numMergedOcc 0
43 mol 220 unq 6 iso 1 dist 9.35184 10.9011 8.60479 5.5295 7.80496 11.1254 numMergedOcc 0
44 mol 220 unq 6 iso 0 dist 9.35184 13.0157 8.75468 10.9011 8.60479 7.23892 numMergedOcc 0
45 mol 220 unq 6 iso 1 dist 9.35184 10.9011 8.60479 13.0157 8.75468 7.23892 numMergedOcc 0
46 mol 260 unq 0 iso 0 dist 9.18439 7.91317 9.05149 7.86533 8.3298 10.3809 numMergedOcc 0
47 mol 260 unq 0 iso 1 dist 9.18439 7.86533 8.3298 7.91317 9.05149 10.3809 numMergedOcc 0
48 mol 261 unq 0 iso 0 dist 6.41477 5.72823 9.56414 9.836 9.64886 9.90349 numMergedOcc 0
49 mol 261 unq 0 iso 1 dist 6.41477 9.836 9.64886 5.72823 9.56414 9.90349 numMergedOcc 0
50 mol 274 unq 0 iso 0 dist 6.12202 5.64335 7.59956 13.0534 8.05503 11.2805 numMergedOcc 0
51 mol 274 unq 0 iso 1 dist 6.12202 13.0534 8.05503 5.64335 7.59956 11.2805 numMergedOcc 0
52 mol 274 unq 1 iso 0 dist 6.12202 5.64335 7.59956 9.24343 5.59151 10.1205 numMergedOcc 0
53 mol 274 unq 1 iso 1 dist 6.12202 9.24343 5.59151 5.64335 7.59956 10.1205 numMergedOcc 0
54 mol 274 unq 1 iso 0 dist 6.12202 13.0534 8.05503 9.24343 5.59151 6.61591 numMergedOcc 0
55 mol 274 unq 1 iso 1 dist 6.12202 9.24343 5.59151 13.0534 8.05503 6.61591 numMergedOcc 0
56 mol 279 unq 0 iso 0 dist 8.78203 12.3869 8.76889 7.27825 7.04397 6.55493 numMergedOcc 0
57 mol 279 unq 0 iso 1 dist 8.78203 7.27825 7.04397 12.3869 8.76889 6.55493 numMergedOcc 0
