0 mol 7 unq 0 iso 0 dist 6.36911 9.87885 7.92429 6.88805 8.81608 12.8006 13.2247 9.36807 6.1206 13.156 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 9.36807 6.1206 7.92429 13.156 8.81608 12.8006 13.2247 6.36911 9.87885 6.88805 numMergedOcc 0
2 mol 72 unq 0 iso 0 dist 8.624 9.74228 9.88768 5.72408 9.37102 13.1318 5.36766 6.77912 7.12321 10.0679 numMergedOcc 0
3 mol 72 unq 1 iso 0 dist 8.624 9.74228 9.88768 5.72408 9.37102 13.1318 7.04035 11.9814 6.21799 10.1392 numMergedOcc 0
4 mol 72 unq 2 iso 0 dist 8.624 9.74228 9.88768 3.94376 5.4605 10.6668 5.36766 6.77912 7.12321 5.69391 numMergedOcc 0
5 mol 72 unq 3 iso 0 dist 8.624 9.74228 9.88768 3.94376 5.4605 10.6668 7.04035 11.9814 6.21799 9.78221 numMergedOcc 0
6 mol 72 unq 4 iso 0 dist 8.624 9.74228 9.88768 6.19288 6.53824 10.9996 5.36766 6.77912 7.12321 4.03844 numMergedOcc 0
7 mol 72 unq 5 iso 0 dist 8.624 9.74228 9.88768 6.19288 6.53824 10.9996 7.04035 11.9814 6.21799 11.5881 numMergedOcc 0
8 mol 72 unq 6 iso 0 dist 6.77912 7.12321 9.88768 10.0679 9.37102 13.1318 5.36766 8.624 9.74228 5.72408 numMergedOcc 0
9 mol 72 unq 7 iso 0 dist 6.77912 7.12321 9.88768 10.0679 9.37102 13.1318 8.24309 11.9814 6.21799 10.1392 numMergedOcc 0
10 mol 72 unq 8 iso 0 dist 6.77912 7.12321 9.88768 5.69391 5.4605 10.6668 5.36766 8.624 9.74228 3.94376 numMergedOcc 0
11 mol 72 unq 9 iso 0 dist 6.77912 7.12321 9.88768 5.69391 5.4605 10.6668 8.24309 11.9814 6.21799 9.78221 numMergedOcc 0
12 mol 72 unq 10 iso 0 dist 6.77912 7.12321 9.88768 4.03844 6.53824 10.9996 5.36766 8.624 9.74228 6.19288 numMergedOcc 0
13 mol 72 unq 11 iso 0 dist 6.77912 7.12321 9.88768 4.03844 6.53824 10.9996 8.24309 11.9814 6.21799 11.5881 numMergedOcc 0
14 mol 76 unq 0 iso 0 dist 6.21982 6.72869 4.00608 5.31985 9.4866 9.59729 10.2879 8.19682 9.85905 15.4159 numMergedOcc 0
15 mol 76 unq 1 iso 0 dist 8.19682 9.85905 4.00608 15.4159 9.4866 9.59729 10.2879 6.21982 6.72869 5.31985 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 7.64585 6.39384 5.65471 6.95773 7.65255 7.65564 7.69052 12.2309 9.42082 6.01673 numMergedOcc 0
17 mol 117 unq 0 iso 0 dist 7.63616 8.19331 5.56883 3.77029 9.94053 10.2505 7.21564 10.6107 8.85711 5.21535 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 8.94837 9.00918 5.58312 11.5407 5.52149 9.54071 14.069 11.0162 9.10524 9.84074 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 8.94837 7.99477 9.61537 11.5407 5.52149 13.1518 6.90348 13.0127 5.35237 15.8453 numMergedOcc 0
20 mol 225 unq 0 iso 0 dist 5.50387 8.1945 3.92979 4.7456 5.93063 9.81207 13.3965 9.88956 6.50998 15.3924 numMergedOcc 0
21 mol 227 unq 0 iso 0 dist 9.62609 6.91318 11.5454 14.6485 9.8009 15.751 5.22356 13.4493 5.23634 18.6436 numMergedOcc 0
22 mol 227 unq 1 iso 0 dist 8.17891 5.23634 4.09934 4.1511 7.79951 6.09335 5.22356 6.95902 6.91318 4.69247 numMergedOcc 0
23 mol 227 unq 2 iso 0 dist 6.95902 6.91318 4.09934 4.69247 7.79951 6.09335 5.22356 8.17891 5.23634 4.1511 numMergedOcc 0
24 mol 234 unq 0 iso 0 dist 9.5707 7.81215 11.8229 3.95629 8.27411 11.2575 10.2693 11.8897 5.64285 12.8018 numMergedOcc 0
25 mol 234 unq 1 iso 0 dist 9.5707 7.81215 11.8229 15.9732 6.96257 15.8278 10.2693 11.8897 5.64285 15.5702 numMergedOcc 0
26 mol 234 unq 2 iso 0 dist 7.85175 7.81215 10.5304 3.95629 7.36208 11.2575 10.2693 13.0678 5.64285 12.8018 numMergedOcc 0
27 mol 235 unq 0 iso 0 dist 6.98084 8.19317 4.47008 8.26028 7.02029 10.8515 7.218 7.32211 5.1823 10.7187 numMergedOcc 0
28 mol 235 unq 1 iso 0 dist 6.98084 6.29377 7.34601 8.26028 7.02029 12.5813 7.218 7.32211 5.70635 10.7187 numMergedOcc 0
29 mol 235 unq 2 iso 0 dist 7.32211 5.1823 4.47008 10.7187 7.02029 10.8515 7.218 6.98084 8.19317 8.26028 numMergedOcc 0
30 mol 235 unq 3 iso 0 dist 7.32211 5.70635 7.34601 10.7187 7.02029 12.5813 7.218 6.98084 6.29377 8.26028 numMergedOcc 0
31 mol 238 unq 0 iso 0 dist 6.55759 9.12776 15.4844 10.4966 9.38131 15.1027 15.7907 21.3432 9.72188 21.5308 numMergedOcc 0
32 mol 238 unq 1 iso 0 dist 7.02475 9.12776 13.037 10.4966 6.85253 15.1027 15.7907 17.436 9.72188 21.5308 numMergedOcc 0
33 mol 238 unq 2 iso 0 dist 7.67322 9.12776 9.75095 5.71717 7.39547 4.66186 15.7907 12.1104 9.72188 10.4706 numMergedOcc 0
34 mol 238 unq 3 iso 0 dist 7.19008 9.12776 6.12722 11.0772 5.43613 9.51483 15.7907 15.0465 9.72188 16.2734 numMergedOcc 0
35 mol 238 unq 4 iso 0 dist 7.19008 9.12776 6.12722 5.71717 7.24334 4.66186 15.7907 15.0465 9.72188 10.4706 numMergedOcc 0
36 mol 259 unq 0 iso 0 dist 7.48005 7.66153 14.0829 10.282 8.84648 17.7558 4.69778 10.9591 9.07743 9.91939 numMergedOcc 0
37 mol 259 unq 1 iso 0 dist 7.48005 7.66153 14.0829 10.067 6.23661 16.4118 4.69778 10.9591 9.07743 11.4598 numMergedOcc 0
