0 mol 4 unq 0 iso 0 dist 9.15878 7.17837 9.63758 9.64534 5.69713 5.74287 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 6.51139 10.8697 6.75602 9.98999 7.80685 9.70119 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 9.09831 6.76039 6.70095 5.78143 8.17003 8.60221 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 8.6338 10.0633 8.8795 4.92345 9.5437 6.30619 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 7.31677 6.30737 8.8795 7.68058 9.5437 6.30619 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 8.62244 10.5984 7.15248 6.31183 7.49869 4.90645 numMergedOcc 0
6 mol 67 unq 1 iso 0 dist 8.62244 9.67456 8.43162 6.31183 7.49869 4.8818 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 7.00234 5.57378 7.03224 4.89784 8.77132 8.63814 numMergedOcc 0
8 mol 69 unq 1 iso 0 dist 7.30652 10.3741 7.03224 4.50543 8.77132 8.63814 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 9.1622 17.0484 8.07498 9.30021 8.30379 12.6035 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 9.1622 12.3943 9.47045 9.30021 8.30379 10.0142 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 7.59013 14.8028 8.07498 6.30613 8.30379 12.6035 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 7.59013 9.57143 9.47045 6.30613 8.30379 10.0142 numMergedOcc 0
13 mol 92 unq 0 iso 0 dist 9.29249 9.44377 7.70612 7.07175 6.40964 5.00872 numMergedOcc 0
14 mol 103 unq 0 iso 0 dist 8.75165 7.3651 6.79959 11.5585 9.06479 7.19464 numMergedOcc 0
15 mol 103 unq 1 iso 0 dist 8.75165 7.3651 6.79959 5.74649 9.90038 5.23889 numMergedOcc 0
16 mol 162 unq 0 iso 0 dist 9.74749 10.4244 9.96586 5.5367 8.6792 13.9849 numMergedOcc 0
17 mol 162 unq 1 iso 0 dist 9.74749 5.55488 7.30751 5.5367 8.6792 7.2417 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 7.81904 6.6097 7.91838 5.47232 8.16906 10.3155 numMergedOcc 0
19 mol 186 unq 1 iso 0 dist 7.81904 6.6097 7.91838 14.0944 9.14238 12.2394 numMergedOcc 0
20 mol 192 unq 0 iso 0 dist 9.78743 13.2525 6.2016 9.60511 9.56785 12.3162 numMergedOcc 0
21 mol 192 unq 1 iso 0 dist 9.78743 13.2525 6.2016 13.796 7.66812 9.54343 numMergedOcc 0
22 mol 195 unq 0 iso 0 dist 9.04342 4.03375 5.61326 13.0074 7.92844 9.48981 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 7.08083 6.46773 4.36421 9.15048 5.96047 4.08418 numMergedOcc 0
24 mol 230 unq 0 iso 0 dist 5.19913 6.28086 9.24729 4.97784 6.86851 5.02022 numMergedOcc 0
25 mol 233 unq 0 iso 0 dist 8.01777 12.4724 6.9103 5.72267 6.92165 8.37961 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 4.53228 10.9464 8.26312 4.52384 7.07461 14.2074 numMergedOcc 0
27 mol 239 unq 1 iso 0 dist 4.53228 6.54316 7.58554 4.52384 7.07461 10.871 numMergedOcc 0
28 mol 239 unq 2 iso 0 dist 8.54078 10.4394 8.26312 8.07771 7.07461 14.2074 numMergedOcc 0
29 mol 239 unq 3 iso 0 dist 8.54078 6.2497 7.58554 8.07771 7.07461 10.871 numMergedOcc 0
30 mol 258 unq 0 iso 0 dist 8.43002 6.30651 8.57274 5.67781 8.35413 11.1831 numMergedOcc 0
31 mol 273 unq 0 iso 0 dist 6.91029 5.64983 6.02879 5.62645 7.63525 6.68682 numMergedOcc 0
32 mol 273 unq 1 iso 0 dist 6.91029 5.64983 6.02879 8.08262 8.57011 5.02587 numMergedOcc 0
