0 mol 1 unq 0 iso 0 dist 8.47429 8.93702 9.45781 7.48521 10.8827 5.96833 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 8.98901 9.34656 5.9201 16.3136 14.3693 8.81608 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 9.12848 8.25905 4.49033 16.1629 12.5137 9.35863 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 9.12848 8.25905 4.49033 6.82841 6.39307 5.04478 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 9.90242 5.97065 5.88467 4.18634 10.8911 5.84066 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 9.07029 5.97065 6.66387 4.18634 9.63803 5.84066 numMergedOcc 0
6 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 6.65242 15.7464 8.63635 numMergedOcc 0
7 mol 95 unq 0 iso 0 dist 6.82522 6.47401 4.41983 13.573 12.7434 9.51318 numMergedOcc 0
8 mol 95 unq 1 iso 0 dist 6.82522 6.47401 4.41983 14.6933 11.5834 9.84457 numMergedOcc 0
9 mol 126 unq 0 iso 0 dist 8.7347 6.35364 4.56139 10.6053 11.2195 8.7789 numMergedOcc 0
10 mol 126 unq 1 iso 0 dist 8.7347 6.35364 4.56139 13.8413 12.9831 9.93613 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 6.26722 4.95674 4.49984 7.44092 12.3021 8.55349 numMergedOcc 0
12 mol 133 unq 1 iso 0 dist 8.78 7.17226 4.49984 11.0449 12.3021 8.55349 numMergedOcc 0
13 mol 133 unq 2 iso 0 dist 5.63173 9.59094 6.2062 13.2035 11.9149 9.10003 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 8.49649 5.98435 11.5532 4.72407 10.6236 6.44575 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 8.49649 5.98435 11.5532 7.97297 8.78303 7.43401 numMergedOcc 0
16 mol 134 unq 2 iso 0 dist 8.49649 8.80672 14.5276 6.67639 14.5055 5.73203 numMergedOcc 0
17 mol 134 unq 3 iso 0 dist 8.49649 8.80672 14.5276 4.4987 10.2498 6.57379 numMergedOcc 0
18 mol 141 unq 0 iso 0 dist 8.47476 9.55297 5.65619 11.0797 5.56446 7.54341 numMergedOcc 0
19 mol 141 unq 1 iso 0 dist 6.74947 9.55297 15.8344 11.0797 17.5171 7.54341 numMergedOcc 0
20 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 11.5968 14.1607 9.74988 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 8.22331 6.58245 4.40086 9.66766 6.0033 9.27218 numMergedOcc 0
22 mol 233 unq 0 iso 0 dist 8.36772 5.34745 8.95188 6.49444 14.0278 8.24424 numMergedOcc 0
23 mol 233 unq 1 iso 0 dist 8.36772 5.34745 8.95188 6.63339 14.4473 7.0942 numMergedOcc 0
24 mol 233 unq 2 iso 0 dist 8.36772 5.34745 8.95188 9.86764 14.4138 6.01775 numMergedOcc 0
25 mol 233 unq 3 iso 0 dist 8.83541 5.34745 5.19341 6.49444 12.9424 8.24424 numMergedOcc 0
26 mol 233 unq 4 iso 0 dist 8.83541 5.34745 5.19341 6.63339 10.9376 7.0942 numMergedOcc 0
27 mol 233 unq 5 iso 0 dist 8.83541 5.34745 5.19341 9.86764 9.52668 6.01775 numMergedOcc 0
28 mol 233 unq 6 iso 0 dist 7.55878 5.34745 5.3674 6.49444 8.7831 8.24424 numMergedOcc 0
29 mol 233 unq 7 iso 0 dist 7.55878 5.34745 5.3674 6.63339 9.61071 7.0942 numMergedOcc 0
30 mol 233 unq 8 iso 0 dist 7.55878 5.34745 5.3674 9.86764 7.1229 6.01775 numMergedOcc 0
31 mol 233 unq 9 iso 0 dist 4.91191 7.99897 5.3674 9.1334 8.7831 8.24424 numMergedOcc 0
32 mol 233 unq 10 iso 0 dist 4.91191 7.99897 5.3674 9.81222 9.61071 7.0942 numMergedOcc 0
33 mol 233 unq 11 iso 0 dist 4.91191 7.99897 5.3674 5.17683 7.1229 6.01775 numMergedOcc 0
34 mol 233 unq 12 iso 0 dist 7.89581 8.98366 5.19341 12.3327 12.9424 8.24424 numMergedOcc 0
35 mol 233 unq 13 iso 0 dist 7.89581 8.98366 5.19341 8.89879 10.9376 7.0942 numMergedOcc 0
36 mol 233 unq 14 iso 0 dist 7.89581 8.98366 5.19341 9.7363 9.52668 6.01775 numMergedOcc 0
37 mol 234 unq 0 iso 0 dist 5.65943 7.54327 4.21173 16.363 12.6209 9.11572 numMergedOcc 0
38 mol 235 unq 0 iso 0 dist 6.91126 9.24964 14.9183 9.94369 16.5297 7.02029 numMergedOcc 0
39 mol 235 unq 1 iso 0 dist 9.48967 9.24964 4.28284 9.94369 11.0152 7.02029 numMergedOcc 0
40 mol 235 unq 2 iso 0 dist 6.43002 5.71896 4.28284 7.91326 11.0152 7.02029 numMergedOcc 0
41 mol 260 unq 0 iso 0 dist 7.90537 9.50619 5.51525 9.31424 7.27503 5.7791 numMergedOcc 0
42 mol 287 unq 0 iso 0 dist 6.38338 8.70062 4.26276 9.8719 10.251 8.59762 numMergedOcc 0
43 mol 288 unq 0 iso 0 dist 6.38338 8.70062 4.26276 9.8719 10.251 8.59762 numMergedOcc 0
44 mol 289 unq 0 iso 0 dist 6.38338 8.70062 4.26276 9.8719 10.251 8.59762 numMergedOcc 0
