0 mol 33 unq 0 iso 0 dist 5.65377 6.96521 8.41282 4.24935 8.66089 9.1841 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 5.65377 6.96521 8.41282 7.00849 6.9181 10.6011 numMergedOcc 0
2 mol 33 unq 2 iso 0 dist 5.65377 6.96521 8.41282 9.8286 5.84349 11.7716 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 7.1365 5.92019 9.10096 3.82305 9.80869 9.20886 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 9.24862 8.52256 8.64047 10.6271 6.24296 12.7386 numMergedOcc 0
5 mol 85 unq 1 iso 0 dist 9.24862 8.52256 8.64047 13.7977 6.83218 14.1999 numMergedOcc 0
6 mol 93 unq 0 iso 0 dist 7.76517 14.6611 8.21739 16.5528 9.43355 4.97727 numMergedOcc 0
7 mol 93 unq 1 iso 0 dist 7.76517 14.6611 8.21739 11.6928 5.64141 5.77343 numMergedOcc 0
8 mol 93 unq 2 iso 0 dist 7.76517 14.6611 8.21739 8.79773 5.46186 11.0802 numMergedOcc 0
9 mol 93 unq 3 iso 0 dist 7.76517 6.1535 4.78377 16.5528 9.43355 13.8087 numMergedOcc 0
10 mol 93 unq 4 iso 0 dist 7.76517 6.1535 4.78377 11.6928 5.64141 9.96831 numMergedOcc 0
11 mol 93 unq 5 iso 0 dist 7.76517 6.1535 4.78377 8.79773 5.46186 5.33894 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 7.3098 6.16378 9.70095 9.06539 8.29463 12.068 numMergedOcc 0
13 mol 100 unq 1 iso 0 dist 9.90038 5.69359 9.70095 14.1132 8.29463 12.068 numMergedOcc 0
14 mol 156 unq 0 iso 0 dist 8.50914 9.68343 6.96911 9.64488 7.96394 14.2552 numMergedOcc 0
15 mol 156 unq 1 iso 0 dist 8.50914 9.68343 6.96911 3.91103 8.01381 7.79956 numMergedOcc 0
16 mol 156 unq 2 iso 0 dist 8.50914 6.9322 9.81276 9.64488 7.96394 14.9876 numMergedOcc 0
17 mol 156 unq 3 iso 0 dist 8.50914 6.9322 9.81276 3.91103 8.01381 5.70715 numMergedOcc 0
18 mol 173 unq 0 iso 0 dist 9.56189 8.37753 9.476 7.91466 5.82174 6.38538 numMergedOcc 0
19 mol 173 unq 1 iso 0 dist 9.56189 14.477 5.77288 7.91466 5.82174 9.14584 numMergedOcc 0
20 mol 186 unq 0 iso 0 dist 8.46429 8.39509 9.18314 5.12552 7.81696 11.924 numMergedOcc 0
21 mol 186 unq 1 iso 0 dist 8.3417 5.26093 9.18314 8.73003 7.81696 11.924 numMergedOcc 0
22 mol 232 unq 0 iso 0 dist 6.92465 6.63253 6.39295 7.21329 8.22129 10.0046 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 7.80478 11.2652 6.69569 5.96447 9.98518 13.2109 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 9.22409 8.52799 6.69569 16.1319 9.98518 13.2109 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 7.80478 11.2652 6.69569 5.96447 9.98518 13.2109 numMergedOcc 0
26 mol 288 unq 1 iso 0 dist 9.22409 8.52799 6.69569 16.1319 9.98518 13.2109 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 7.80478 11.2652 6.69569 5.96447 9.98518 13.2109 numMergedOcc 0
28 mol 289 unq 1 iso 0 dist 9.22409 8.52799 6.69569 16.1319 9.98518 13.2109 numMergedOcc 0
