0 mol 32 unq 0 iso 0 dist 7.6082 9.43074 5.07365 4.71264 6.67704 6.44044 3.82644 6.93709 6.59787 3.28726 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 4.09276 4.85885 8.14455 4.71264 6.67079 8.69625 3.82644 6.38271 7.23274 3.28726 numMergedOcc 0
2 mol 32 unq 2 iso 0 dist 9.24687 4.77113 5.07365 8.5755 6.67704 6.44044 7.47409 6.93709 6.59787 3.28726 numMergedOcc 0
3 mol 34 unq 0 iso 0 dist 5.68877 4.31815 6.44329 9.52807 8.71284 7.80178 5.22301 9.36493 4.62291 7.83556 numMergedOcc 0
4 mol 34 unq 1 iso 0 dist 5.68877 4.31815 6.44329 9.52807 8.71284 7.80178 9.36704 9.0665 5.28477 6.59793 numMergedOcc 0
5 mol 34 unq 2 iso 0 dist 5.68877 4.31815 6.44329 9.52807 8.71284 7.80178 12.1168 7.07773 10.6246 9.10687 numMergedOcc 0
6 mol 34 unq 3 iso 0 dist 5.68877 8.62215 8.94846 9.52807 8.71284 13.7276 5.22301 9.36493 12.295 7.83556 numMergedOcc 0
7 mol 34 unq 4 iso 0 dist 5.68877 8.62215 8.94846 9.52807 8.71284 13.7276 9.36704 9.0665 16.5713 6.59793 numMergedOcc 0
8 mol 34 unq 5 iso 0 dist 5.68877 8.62215 8.94846 9.52807 8.71284 13.7276 12.1168 7.07773 14.9436 9.10687 numMergedOcc 0
9 mol 44 unq 0 iso 0 dist 7.41011 12.906 8.99723 10.0797 5.81645 4.47203 3.76713 9.80946 14.5467 12.6428 numMergedOcc 0
10 mol 44 unq 1 iso 0 dist 7.41011 12.906 8.99723 6.29545 6.75026 7.11688 3.76713 9.80946 14.5467 8.28169 numMergedOcc 0
11 mol 54 unq 0 iso 0 dist 8.34361 12.1383 4.54428 14.9943 9.57335 10.068 2.97898 9.63616 13.0814 17.4558 numMergedOcc 0
12 mol 54 unq 1 iso 0 dist 8.34361 12.1383 4.54428 11.5332 8.60653 10.6382 2.97898 9.63616 13.0814 14.2852 numMergedOcc 0
13 mol 79 unq 0 iso 0 dist 6.96066 15.7768 9.97253 4.22631 4.3247 13.4809 5.73969 4.5892 10.5865 5.88927 numMergedOcc 0
14 mol 98 unq 0 iso 0 dist 8.04448 8.19607 7.80347 17.0849 9.40173 14.6729 9.39313 5.24616 4.65764 10.256 numMergedOcc 0
15 mol 131 unq 0 iso 0 dist 7.46875 10.4143 9.12773 4.34786 5.43662 10.5805 3.97269 8.44004 7.51072 5.92118 numMergedOcc 0
16 mol 185 unq 0 iso 0 dist 7.18997 8.51 8.21075 6.26644 8.7695 13.85 3.82689 7.35584 4.96002 9.87079 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 9.87224 9.61496 9.01934 5.38925 9.25097 5.67269 13.7613 7.99963 8.18179 12.3078 numMergedOcc 0
18 mol 241 unq 0 iso 0 dist 7.30582 9.21526 9.86427 10.7816 9.14228 5.71704 8.48642 9.87415 12.788 16.0653 numMergedOcc 0
