0 mol 53 unq 0 iso 0 dist 9.99188 13.4924 9.23241 9.90261 8.83047 6.76039 numMergedOcc 0
1 mol 53 unq 1 iso 0 dist 9.99188 13.4924 9.23241 6.43175 6.95013 14.2926 numMergedOcc 0
2 mol 55 unq 0 iso 0 dist 7.66306 4.19247 8.37544 4.13365 7.43154 6.56327 numMergedOcc 0
3 mol 55 unq 1 iso 0 dist 7.66306 6.83997 4.92955 4.13365 7.43154 6.40817 numMergedOcc 0
4 mol 63 unq 0 iso 0 dist 7.76666 6.11728 5.9644 9.19107 9.16658 11.2919 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 9.85244 13.3885 7.81334 7.90839 4.66377 7.08972 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 6.20301 4.91384 7.49224 9.91621 7.73993 12.1962 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 9.13886 11.5393 7.98999 8.25645 7.35503 14.3349 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 9.13886 11.5393 7.98999 11.3476 8.79543 15.4161 numMergedOcc 0
9 mol 112 unq 2 iso 0 dist 9.13886 11.5393 7.98999 13.8988 6.48223 9.87475 numMergedOcc 0
10 mol 120 unq 0 iso 0 dist 8.26098 9.29912 9.07172 6.24905 8.40669 9.31366 numMergedOcc 0
11 mol 163 unq 0 iso 0 dist 9.07256 5.72937 9.3832 15.8633 9.29539 17.2409 numMergedOcc 0
12 mol 163 unq 1 iso 0 dist 9.07256 5.72937 9.3832 16.2121 9.02124 14.7097 numMergedOcc 0
13 mol 163 unq 2 iso 0 dist 9.07256 10.1929 6.0247 15.8633 9.29539 8.52732 numMergedOcc 0
14 mol 163 unq 3 iso 0 dist 9.07256 10.1929 6.0247 16.2121 9.02124 12.8414 numMergedOcc 0
15 mol 163 unq 4 iso 0 dist 9.07256 6.65976 6.40873 15.8633 9.29539 10.0505 numMergedOcc 0
16 mol 163 unq 5 iso 0 dist 9.07256 6.65976 6.40873 16.2121 9.02124 14.9092 numMergedOcc 0
17 mol 173 unq 0 iso 0 dist 5.77288 3.95563 5.36078 5.45307 4.0037 7.46995 numMergedOcc 0
18 mol 173 unq 1 iso 0 dist 8.44376 8.4136 5.36078 10.8947 4.0037 7.46995 numMergedOcc 0
19 mol 183 unq 0 iso 0 dist 7.48868 12.8394 8.84125 9.18923 6.76315 4.0252 numMergedOcc 0
20 mol 183 unq 1 iso 0 dist 7.48868 10.6398 8.23616 9.18923 6.76315 5.66126 numMergedOcc 0
21 mol 183 unq 2 iso 0 dist 6.79048 10.9065 8.84125 7.14992 6.76315 4.0252 numMergedOcc 0
22 mol 183 unq 3 iso 0 dist 6.79048 5.27994 8.23616 7.14992 6.76315 5.66126 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 8.31175 10.0929 5.63154 14.4404 8.84798 13.1905 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 4.37724 5.42154 9.2542 9.43216 9.21767 9.02274 numMergedOcc 0
25 mol 294 unq 1 iso 0 dist 4.37724 5.42154 9.2542 4.06072 6.16375 5.83603 numMergedOcc 0
