0 mol 15 unq 0 iso 0 dist 5.72359 8.02297 9.97769 6.16313 8.111 4.41883 numMergedOcc 0
1 mol 15 unq 1 iso 0 dist 6.26048 9.48078 9.97769 5.68513 8.111 4.41883 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 5.22014 7.14863 6.36381 10.212 7.27472 5.80023 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 7.93454 3.93956 9.81143 10.6266 7.18022 9.84195 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 9.06898 3.93956 9.78839 10.6266 6.24711 9.84195 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.25047 4.35001 6.63973 6.4988 8.23026 9.42791 numMergedOcc 0
6 mol 89 unq 0 iso 0 dist 9.55954 9.72874 7.55644 6.529 6.53308 6.46605 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 6.13521 12.0992 9.43496 4.78289 7.06939 9.56471 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 5.44426 9.91645 8.3505 9.04817 5.10496 4.75138 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 5.44426 9.91645 8.3505 4.70157 5.92242 10.4417 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 5.44426 9.91645 8.3505 6.21302 5.2571 11.3628 numMergedOcc 0
11 mol 98 unq 3 iso 0 dist 5.44426 9.91645 8.3505 11.2075 8.7497 13.9599 numMergedOcc 0
12 mol 98 unq 4 iso 0 dist 7.63284 9.91645 7.34638 4.70157 7.02507 10.4417 numMergedOcc 0
13 mol 98 unq 5 iso 0 dist 7.63284 7.54723 6.0995 4.70157 7.02507 9.63267 numMergedOcc 0
14 mol 98 unq 6 iso 0 dist 8.65429 12.341 5.33961 8.35877 9.64383 11.1668 numMergedOcc 0
15 mol 98 unq 7 iso 0 dist 8.65429 12.341 5.33961 9.9123 7.54889 12.7318 numMergedOcc 0
16 mol 98 unq 8 iso 0 dist 8.65429 12.341 5.33961 8.49566 7.78931 12.3835 numMergedOcc 0
17 mol 98 unq 9 iso 0 dist 8.65429 12.5957 9.29816 8.35877 9.64383 5.70962 numMergedOcc 0
18 mol 98 unq 10 iso 0 dist 8.65429 12.5957 9.29816 9.9123 7.54889 14.676 numMergedOcc 0
19 mol 98 unq 11 iso 0 dist 8.65429 12.5957 9.29816 8.49566 7.78931 16.3389 numMergedOcc 0
20 mol 98 unq 12 iso 0 dist 8.65429 4.74936 5.08983 8.35877 9.64383 10.1978 numMergedOcc 0
21 mol 98 unq 13 iso 0 dist 8.65429 4.74936 5.08983 9.9123 7.54889 7.1452 numMergedOcc 0
22 mol 98 unq 14 iso 0 dist 8.65429 4.74936 5.08983 8.49566 7.78931 4.96747 numMergedOcc 0
23 mol 109 unq 0 iso 0 dist 5.33967 8.86634 6.67635 5.15479 7.86666 10.0698 numMergedOcc 0
24 mol 109 unq 1 iso 0 dist 5.33967 8.86634 6.67635 14.949 9.77497 11.8455 numMergedOcc 0
25 mol 115 unq 0 iso 0 dist 9.21978 11.9272 8.42219 10.3475 6.39384 5.24961 numMergedOcc 0
26 mol 115 unq 1 iso 0 dist 9.21978 11.9272 8.42219 6.86762 9.42082 11.8122 numMergedOcc 0
27 mol 129 unq 0 iso 0 dist 8.62413 4.04119 6.53559 5.57978 5.51197 6.43966 numMergedOcc 0
28 mol 129 unq 1 iso 0 dist 8.62413 10.1824 8.09774 5.57978 5.51197 5.56946 numMergedOcc 0
29 mol 129 unq 2 iso 0 dist 6.93102 4.04119 7.90844 5.57978 8.86944 6.43966 numMergedOcc 0
30 mol 134 unq 0 iso 0 dist 9.8564 17.8575 8.78303 12.0294 9.33094 11.9294 numMergedOcc 0
31 mol 134 unq 1 iso 0 dist 9.8564 17.8575 8.78303 14.9183 8.69531 6.36794 numMergedOcc 0
32 mol 186 unq 0 iso 0 dist 8.28282 3.8834 6.52441 11.3614 7.2793 11.7795 numMergedOcc 0
33 mol 197 unq 0 iso 0 dist 9.67667 9.31539 6.0033 9.73282 9.10817 7.56497 numMergedOcc 0
34 mol 197 unq 1 iso 0 dist 9.67667 9.31539 6.0033 4.74864 6.86828 5.66137 numMergedOcc 0
35 mol 213 unq 0 iso 0 dist 5.81317 4.10002 9.45658 5.69131 7.94911 7.05959 numMergedOcc 0
36 mol 273 unq 0 iso 0 dist 7.05843 12.78 8.89714 6.95085 6.31969 8.50795 numMergedOcc 0
37 mol 292 unq 0 iso 0 dist 9.65996 11.7004 7.78796 6.39438 9.74118 6.94727 numMergedOcc 0
