0 mol 5 unq 0 iso 0 dist 6.96805 13.0853 9.75695 11.6519 9.45559 6.6619 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 6.96805 13.0853 9.75695 12.0161 7.4332 3.9731 numMergedOcc 0
2 mol 6 unq 0 iso 0 dist 9.38351 16.4452 7.27315 16.6659 8.15992 5.69098 numMergedOcc 0
3 mol 8 unq 0 iso 0 dist 9.59644 14.4137 8.13238 6.27069 6.52138 8.53141 numMergedOcc 0
4 mol 8 unq 1 iso 0 dist 6.68091 7.36439 6.84065 4.66983 9.31461 11.6611 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.09675 10.8929 6.73832 11.1342 9.85386 8.50831 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 8.09675 10.8929 6.73832 8.22845 4.8983 11.3918 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 8.09675 13.4503 7.85973 11.1342 9.85386 11.1595 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 8.09675 13.4503 7.85973 8.22845 4.8983 6.29235 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 9.02753 12.9493 6.73832 10.0544 9.85386 8.50831 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 9.02753 12.9493 6.73832 6.96897 4.8983 11.3918 numMergedOcc 0
11 mol 73 unq 6 iso 0 dist 9.02753 11.032 7.85973 10.0544 9.85386 11.1595 numMergedOcc 0
12 mol 73 unq 7 iso 0 dist 9.02753 11.032 7.85973 6.96897 4.8983 6.29235 numMergedOcc 0
13 mol 88 unq 0 iso 0 dist 5.74637 9.22301 8.30943 4.56066 5.6516 9.8511 numMergedOcc 0
14 mol 92 unq 0 iso 0 dist 5.53726 13.3931 9.46036 11.0283 6.34669 7.81379 numMergedOcc 0
15 mol 102 unq 0 iso 0 dist 9.22651 7.92108 4.84683 10.0473 9.51771 11.0943 numMergedOcc 0
16 mol 102 unq 1 iso 0 dist 5.32892 4.51114 4.84683 7.08749 9.51771 11.0943 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 9.09918 10.3282 7.56704 5.78374 7.75833 5.0614 numMergedOcc 0
18 mol 141 unq 0 iso 0 dist 9.28415 14.6516 9.71493 15.6885 9.57243 8.36223 numMergedOcc 0
19 mol 141 unq 1 iso 0 dist 9.28415 14.6516 9.71493 7.06015 8.12558 8.84981 numMergedOcc 0
20 mol 174 unq 0 iso 0 dist 4.77805 6.26669 7.22982 7.70204 8.46317 9.25932 numMergedOcc 0
21 mol 186 unq 0 iso 0 dist 5.31333 9.85164 8.79089 12.2056 8.99777 5.21542 numMergedOcc 0
22 mol 186 unq 1 iso 0 dist 5.83898 9.95786 6.20806 3.85596 5.97886 11.6303 numMergedOcc 0
23 mol 211 unq 0 iso 0 dist 9.26542 12.6119 9.49714 6.3032 5.49212 8.87273 numMergedOcc 0
24 mol 211 unq 1 iso 0 dist 9.26542 12.6119 9.49714 6.17106 9.79135 13.3043 numMergedOcc 0
25 mol 211 unq 2 iso 0 dist 9.26542 13.9661 7.83543 6.3032 5.49212 8.09982 numMergedOcc 0
26 mol 211 unq 3 iso 0 dist 9.26542 13.9661 7.83543 6.17106 9.79135 10.4363 numMergedOcc 0
27 mol 225 unq 0 iso 0 dist 7.47852 10.7954 9.10325 11.337 7.78392 9.71885 numMergedOcc 0
28 mol 225 unq 1 iso 0 dist 6.22332 5.60637 9.10325 7.99586 7.78392 9.71885 numMergedOcc 0
29 mol 254 unq 0 iso 0 dist 8.76115 15.9221 9.47137 12.9566 8.30975 14.1834 numMergedOcc 0
30 mol 254 unq 1 iso 0 dist 8.76115 15.9221 9.47137 10.5182 8.10036 13.5753 numMergedOcc 0
31 mol 254 unq 2 iso 0 dist 8.76115 15.9221 9.47137 10.2653 8.96529 7.97284 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 9.46746 5.37406 9.97041 3.78294 9.48672 8.60347 numMergedOcc 0
33 mol 258 unq 1 iso 0 dist 9.46746 13.1092 9.29827 3.78294 9.48672 10.2524 numMergedOcc 0
34 mol 258 unq 2 iso 0 dist 7.31698 10.9424 9.97041 5.23608 9.48672 8.60347 numMergedOcc 0
35 mol 258 unq 3 iso 0 dist 7.31698 5.26898 9.29827 5.23608 9.48672 10.2524 numMergedOcc 0
36 mol 268 unq 0 iso 0 dist 8.43164 5.07611 7.78717 3.43113 7.40323 7.56592 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 6.28023 7.64336 8.04439 7.72539 8.67957 12.2565 numMergedOcc 0
38 mol 286 unq 0 iso 0 dist 8.97304 11.0772 9.92773 6.60143 8.08382 11.1153 numMergedOcc 0
39 mol 287 unq 0 iso 0 dist 7.47179 9.43796 8.50964 5.42266 8.73403 11.0976 numMergedOcc 0
40 mol 288 unq 0 iso 0 dist 7.47179 9.43796 8.50964 5.42266 8.73403 11.0976 numMergedOcc 0
41 mol 289 unq 0 iso 0 dist 7.47179 9.43796 8.50964 5.42266 8.73403 11.0976 numMergedOcc 0
