0 mol 24 unq 0 iso 0 dist 8.94703 6.40447 7.77964 6.11056 4.79736 8.09311 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 5.77745 5.23233 8.07318 8.6396 6.47509 6.55597 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 5.77745 6.29702 7.44277 8.40051 5.63212 4.79873 numMergedOcc 0
3 mol 25 unq 2 iso 0 dist 8.27137 10.1908 7.44277 16.9711 11.6045 7.05196 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 7.93171 7.2452 8.77529 7.20538 9.96534 9.03564 numMergedOcc 0
5 mol 59 unq 0 iso 0 dist 9.01601 11.4478 8.66724 10.3722 6.08003 6.56212 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.762 10.8441 8.46627 12.1964 6.41115 5.5087 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 9.762 10.8441 8.46627 8.67532 5.9144 5.61588 numMergedOcc 0
8 mol 73 unq 2 iso 0 dist 9.762 15.2203 9.22208 12.1964 6.41115 6.08682 numMergedOcc 0
9 mol 73 unq 3 iso 0 dist 9.762 15.2203 9.22208 8.67532 5.9144 7.83244 numMergedOcc 0
10 mol 92 unq 0 iso 0 dist 9.68629 5.92795 9.99441 12.5764 6.77937 9.36001 numMergedOcc 0
11 mol 92 unq 1 iso 0 dist 9.54368 6.58337 8.89015 13.8027 6.95017 9.33861 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 9.46621 9.78374 9.09348 11.1103 5.00433 7.07971 numMergedOcc 0
13 mol 109 unq 1 iso 0 dist 9.94704 8.08642 9.09348 8.3164 5.00433 7.07971 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 8.42219 8.29196 7.65564 12.5192 6.63111 6.24825 numMergedOcc 0
15 mol 134 unq 0 iso 0 dist 8.78303 4.63732 8.62504 9.60369 4.46337 9.66543 numMergedOcc 0
16 mol 134 unq 1 iso 0 dist 8.78303 4.63732 8.62504 9.55556 7.41373 7.21868 numMergedOcc 0
17 mol 134 unq 2 iso 0 dist 8.78303 4.63732 8.62504 12.1043 10.8635 7.93372 numMergedOcc 0
18 mol 178 unq 0 iso 0 dist 9.42866 13.0468 7.86352 18.6643 10.8974 7.06025 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 6.26168 3.6848 8.5672 8.96988 5.75483 8.90571 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 6.26168 3.6848 8.5672 9.44405 10.8286 6.61112 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 6.90791 5.37149 6.69042 12.089 9.61454 9.10817 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 6.90791 5.37149 6.69042 11.2162 7.59871 6.86828 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 6.41148 6.10058 5.03818 10.044 4.3093 7.21137 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 6.41148 6.10058 5.03818 12.1752 8.90569 8.4844 numMergedOcc 0
25 mol 205 unq 2 iso 0 dist 5.06713 3.50446 5.03818 8.84602 4.3093 7.21137 numMergedOcc 0
26 mol 205 unq 3 iso 0 dist 5.06713 3.50446 5.03818 8.10287 8.90569 8.4844 numMergedOcc 0
27 mol 205 unq 4 iso 0 dist 8.69512 3.50446 6.40171 8.84602 7.94891 7.21137 numMergedOcc 0
28 mol 205 unq 5 iso 0 dist 8.69512 3.50446 6.40171 8.10287 6.37317 8.4844 numMergedOcc 0
29 mol 206 unq 0 iso 0 dist 8.79378 9.39446 9.95026 10.1863 5.14674 9.21377 numMergedOcc 0
30 mol 207 unq 0 iso 0 dist 6.50724 6.29106 4.76113 10.0544 4.56899 5.12567 numMergedOcc 0
31 mol 222 unq 0 iso 0 dist 8.86886 4.91709 8.14294 7.85877 8.34852 5.56538 numMergedOcc 0
32 mol 222 unq 1 iso 0 dist 8.86886 5.96186 5.72 7.85877 8.34852 7.48954 numMergedOcc 0
33 mol 225 unq 0 iso 0 dist 9.49163 12.7092 6.46405 15.7669 6.28241 8.14831 numMergedOcc 0
34 mol 225 unq 1 iso 0 dist 9.99149 11.662 6.46405 16.0039 6.28241 8.14831 numMergedOcc 0
35 mol 227 unq 0 iso 0 dist 8.79884 5.25298 6.09335 9.96308 4.1511 5.23634 numMergedOcc 0
36 mol 227 unq 1 iso 0 dist 8.79884 5.25298 6.09335 9.95674 4.69247 6.91318 numMergedOcc 0
37 mol 238 unq 0 iso 0 dist 6.96382 3.68226 4.66186 11.6545 5.71717 9.12776 numMergedOcc 0
38 mol 238 unq 1 iso 0 dist 6.96382 3.68226 4.66186 10.2894 10.4706 9.72188 numMergedOcc 0
39 mol 264 unq 0 iso 0 dist 9.13546 3.63202 9.78237 7.36905 5.71153 5.90924 numMergedOcc 0
40 mol 264 unq 1 iso 0 dist 9.13546 3.63202 9.78237 9.43335 12.6872 5.90058 numMergedOcc 0
41 mol 264 unq 2 iso 0 dist 9.13546 3.63202 9.78237 6.83408 6.56539 9.58916 numMergedOcc 0
42 mol 264 unq 3 iso 0 dist 8.7365 3.63202 9.95798 7.36905 6.87635 5.90924 numMergedOcc 0
43 mol 264 unq 4 iso 0 dist 8.7365 3.63202 9.95798 9.43335 12.9337 5.90058 numMergedOcc 0
44 mol 264 unq 5 iso 0 dist 8.7365 3.63202 9.95798 6.83408 4.76241 9.58916 numMergedOcc 0
45 mol 264 unq 6 iso 0 dist 7.19658 13.3131 9.78237 11.1873 5.71153 5.90924 numMergedOcc 0
46 mol 264 unq 7 iso 0 dist 7.19658 13.3131 9.78237 16.8768 12.6872 5.90058 numMergedOcc 0
47 mol 264 unq 8 iso 0 dist 7.19658 13.3131 9.78237 10.6712 6.56539 9.58916 numMergedOcc 0
