0 mol 9 unq 0 iso 0 dist 9.47063 8.14998 13.4984 6.28575 14.4627 6.11048 numMergedOcc 0
1 mol 58 unq 0 iso 0 dist 9.92355 9.23438 8.76454 5.35073 7.68678 7.17488 numMergedOcc 0
2 mol 58 unq 1 iso 0 dist 9.92355 9.23438 8.76454 10.8153 14.171 6.79356 numMergedOcc 0
3 mol 58 unq 2 iso 0 dist 7.68678 7.17488 8.76454 5.35073 9.92355 9.23438 numMergedOcc 0
4 mol 58 unq 3 iso 0 dist 7.68678 7.17488 8.76454 8.62958 14.171 6.79356 numMergedOcc 0
5 mol 72 unq 0 iso 0 dist 9.27838 4.86198 13.6186 5.36766 11.1896 8.26541 numMergedOcc 0
6 mol 72 unq 1 iso 0 dist 9.27838 4.86198 13.6186 8.24309 16.0048 6.62699 numMergedOcc 0
7 mol 72 unq 2 iso 0 dist 9.27838 4.86198 13.6186 10.1538 18.5388 8.98867 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 6.02816 8.62079 12.0718 8.07446 12.4089 7.37171 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 8.18107 5.42067 4.30488 5.04493 9.8859 7.36435 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 5.9465 5.42067 5.09449 5.04493 6.97962 7.36435 numMergedOcc 0
11 mol 92 unq 2 iso 0 dist 9.8859 7.36435 4.30488 5.04493 8.18107 5.42067 numMergedOcc 0
12 mol 92 unq 3 iso 0 dist 6.97962 7.36435 5.09449 5.04493 5.9465 5.42067 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 8.99399 7.60162 5.77063 8.61848 9.84094 4.80684 numMergedOcc 0
14 mol 130 unq 0 iso 0 dist 8.78276 8.81797 3.88766 4.5207 7.88805 9.81269 numMergedOcc 0
15 mol 130 unq 1 iso 0 dist 8.78276 8.81797 3.88766 8.38345 7.96646 5.92733 numMergedOcc 0
16 mol 130 unq 2 iso 0 dist 7.88805 9.81269 3.88766 4.5207 8.78276 8.81797 numMergedOcc 0
17 mol 130 unq 3 iso 0 dist 7.88805 9.81269 3.88766 10.0969 7.96646 5.92733 numMergedOcc 0
18 mol 130 unq 4 iso 0 dist 7.96646 5.92733 3.88766 8.38345 8.78276 8.81797 numMergedOcc 0
19 mol 130 unq 5 iso 0 dist 7.96646 5.92733 3.88766 10.0969 7.88805 9.81269 numMergedOcc 0
20 mol 206 unq 0 iso 0 dist 6.16414 4.51255 9.36584 5.63422 7.75885 6.23183 numMergedOcc 0
21 mol 206 unq 1 iso 0 dist 7.75885 6.23183 9.36584 5.63422 6.16414 4.51255 numMergedOcc 0
22 mol 206 unq 2 iso 0 dist 7.33701 4.51255 8.97305 5.63422 11.4872 6.23183 numMergedOcc 0
23 mol 206 unq 3 iso 0 dist 8.0871 4.51255 8.90838 5.63422 13.2041 6.23183 numMergedOcc 0
24 mol 213 unq 0 iso 0 dist 7.37798 8.82761 15.5804 5.45334 11.8877 4.66576 numMergedOcc 0
25 mol 213 unq 1 iso 0 dist 7.73322 8.82761 6.78109 5.45334 8.14332 4.66576 numMergedOcc 0
26 mol 213 unq 2 iso 0 dist 8.14332 4.66576 6.78109 5.45334 7.73322 8.82761 numMergedOcc 0
27 mol 238 unq 0 iso 0 dist 8.94014 8.94231 13.4894 5.6348 7.02333 8.88652 numMergedOcc 0
28 mol 238 unq 1 iso 0 dist 8.94014 8.94231 13.4894 8.87326 8.67864 6.46771 numMergedOcc 0
29 mol 238 unq 2 iso 0 dist 7.02333 8.88652 13.4894 5.6348 8.94014 8.94231 numMergedOcc 0
30 mol 238 unq 3 iso 0 dist 7.02333 8.88652 13.4894 5.31152 8.67864 6.46771 numMergedOcc 0
31 mol 238 unq 4 iso 0 dist 8.67864 6.46771 13.4894 8.87326 8.94014 8.94231 numMergedOcc 0
32 mol 238 unq 5 iso 0 dist 8.67864 6.46771 13.4894 5.31152 7.02333 8.88652 numMergedOcc 0
33 mol 258 unq 0 iso 0 dist 7.6595 5.4557 7.26991 5.55477 12.2124 6.76495 numMergedOcc 0
34 mol 278 unq 0 iso 0 dist 6.62841 5.35705 10.5492 5.74345 11.3027 6.64378 numMergedOcc 0
35 mol 287 unq 0 iso 0 dist 9.65934 5.30118 5.39801 4.8356 14.0537 8.98698 numMergedOcc 0
36 mol 288 unq 0 iso 0 dist 9.65934 5.30118 5.39801 4.8356 14.0537 8.98698 numMergedOcc 0
37 mol 289 unq 0 iso 0 dist 9.65934 5.30118 5.39801 4.8356 14.0537 8.98698 numMergedOcc 0
