0 mol 6 unq 0 iso 0 dist 9.50612 6.88535 8.15992 11.3517 5.27713 6.36157 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 6.46784 10.5682 8.15992 10.7376 5.27713 6.36157 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.09015 9.573 7.83083 14.842 15.0188 9.29504 numMergedOcc 0
3 mol 10 unq 1 iso 0 dist 7.82815 12.3587 7.83083 20.9655 15.0188 9.29504 numMergedOcc 0
4 mol 10 unq 2 iso 0 dist 7.70383 9.573 6.90469 14.842 12.4341 9.29504 numMergedOcc 0
5 mol 21 unq 0 iso 0 dist 8.7443 5.38502 5.92388 9.76497 3.36756 8.6232 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 9.74777 6.22149 8.11143 10.1372 4.19221 5.85737 numMergedOcc 0
7 mol 32 unq 0 iso 0 dist 5.78231 8.7845 8.70331 9.38777 4.52962 9.28158 numMergedOcc 0
8 mol 32 unq 1 iso 0 dist 9.41538 11.8855 8.70331 12.627 4.52962 9.28158 numMergedOcc 0
9 mol 43 unq 0 iso 0 dist 9.72036 10.5856 8.81562 8.54999 3.83842 7.21995 numMergedOcc 0
10 mol 48 unq 0 iso 0 dist 9.48328 4.99432 5.43913 9.7516 13.4515 9.53081 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 8.63792 8.29882 5.91098 9.76901 8.58474 7.48127 numMergedOcc 0
12 mol 78 unq 0 iso 0 dist 8.39335 6.59097 6.11101 11.8447 7.86077 9.86325 numMergedOcc 0
13 mol 90 unq 0 iso 0 dist 6.77993 7.89197 8.63446 9.69413 6.65219 9.06641 numMergedOcc 0
14 mol 96 unq 0 iso 0 dist 7.22615 6.04753 8.79886 9.25941 11.9221 8.9056 numMergedOcc 0
15 mol 116 unq 0 iso 0 dist 7.65919 5.88698 9.12145 6.24768 4.82514 6.53824 numMergedOcc 0
16 mol 116 unq 1 iso 0 dist 7.65919 5.88698 9.12145 9.31875 8.63935 6.61973 numMergedOcc 0
17 mol 124 unq 0 iso 0 dist 8.06631 12.0208 8.50362 8.45451 5.3096 7.18976 numMergedOcc 0
18 mol 133 unq 0 iso 0 dist 6.01995 13.2228 9.35049 8.61918 4.63862 5.79195 numMergedOcc 0
19 mol 157 unq 0 iso 0 dist 8.97914 6.72897 8.36016 6.97303 5.07066 6.8976 numMergedOcc 0
20 mol 158 unq 0 iso 0 dist 8.24681 11.1698 9.27714 11.875 3.91702 9.38856 numMergedOcc 0
21 mol 158 unq 1 iso 0 dist 6.51748 10.0941 9.27714 10.1425 3.91702 9.38856 numMergedOcc 0
22 mol 204 unq 0 iso 0 dist 9.38235 8.80016 9.92651 15.3381 11.8097 9.52029 numMergedOcc 0
23 mol 204 unq 1 iso 0 dist 9.98617 14.5106 9.26192 14.3178 11.1365 9.90757 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 8.20259 9.89233 7.95917 12.4488 4.68656 8.05949 numMergedOcc 0
25 mol 239 unq 0 iso 0 dist 5.91094 5.77901 7.24545 11.2468 7.17772 9.01071 numMergedOcc 0
26 mol 239 unq 1 iso 0 dist 5.91094 5.77901 7.24545 12.4501 13.8399 8.86185 numMergedOcc 0
27 mol 252 unq 0 iso 0 dist 5.2116 6.07355 9.09279 10.6786 10.2121 8.19645 numMergedOcc 0
28 mol 254 unq 0 iso 0 dist 7.94753 5.4699 5.83039 12.5744 5.9731 9.54511 numMergedOcc 0
29 mol 254 unq 1 iso 0 dist 9.99046 5.4699 6.74364 12.5744 3.69576 9.54511 numMergedOcc 0
30 mol 258 unq 0 iso 0 dist 4.98907 5.83092 5.94328 6.77021 5.05766 8.58092 numMergedOcc 0
31 mol 258 unq 1 iso 0 dist 4.98907 5.09024 7.91978 6.77021 5.05766 7.40014 numMergedOcc 0
32 mol 266 unq 0 iso 0 dist 5.28746 5.36882 6.48382 10.3532 7.63149 9.0836 numMergedOcc 0
33 mol 266 unq 1 iso 0 dist 5.28746 5.36882 6.48382 8.65743 4.39553 9.62494 numMergedOcc 0
34 mol 274 unq 0 iso 0 dist 9.89615 18.0386 8.67957 13.119 4.66969 9.34051 numMergedOcc 0
35 mol 274 unq 1 iso 0 dist 5.77565 7.77559 8.67957 8.95153 4.66969 9.34051 numMergedOcc 0
36 mol 284 unq 0 iso 0 dist 5.2862 12.6047 8.2236 17.157 11.8933 7.74965 numMergedOcc 0
37 mol 284 unq 1 iso 0 dist 5.31097 10.936 8.2236 16.1417 11.8933 7.74965 numMergedOcc 0
38 mol 294 unq 0 iso 0 dist 7.58948 4.06072 7.94656 5.25409 3.33848 6.37998 numMergedOcc 0
