0 mol 5 unq 0 iso 0 dist 7.8351 7.4332 10.4078 8.33646 13.4519 6.14476 8.94762 15.8919 8.34817 4.70478 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.23212 9.74528 9.68636 7.86896 4.61088 6.84216 11.3059 6.54358 9.89425 4.10106 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 9.89021 4.8983 10.8482 4.30874 11.1436 7.37171 5.75925 14.0851 4.27766 6.41115 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 9.89021 4.8983 10.8482 6.97502 16.8583 8.62079 5.75925 14.0851 4.27766 5.9144 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 4.83274 5.91098 3.69293 10.2219 6.97941 7.61521 13.363 10.2456 9.57759 4.09069 numMergedOcc 0
5 mol 76 unq 1 iso 0 dist 7.89214 4.86523 3.69293 7.74851 6.97941 7.61521 7.37421 10.2456 9.57759 4.09069 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 8.26838 9.02905 4.73066 4.33346 9.03572 7.51733 8.32734 8.27883 4.3439 4.99174 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 8.26838 9.02905 4.73066 4.33346 9.03572 7.51733 4.79063 5.75428 6.05855 4.46005 numMergedOcc 0
8 mol 95 unq 2 iso 0 dist 8.26838 9.02905 4.73066 7.47119 8.83255 9.01607 8.32734 8.27883 4.3439 8.67311 numMergedOcc 0
9 mol 95 unq 3 iso 0 dist 8.26838 9.02905 4.73066 7.47119 8.83255 9.01607 4.79063 5.75428 6.05855 3.94293 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 8.35164 9.64908 6.35793 10.746 11.5121 6.87434 6.13615 9.02706 5.92828 6.95317 numMergedOcc 0
11 mol 112 unq 1 iso 0 dist 8.35164 9.64908 6.35793 10.746 11.5121 6.87434 4.49971 9.39168 9.1247 7.57713 numMergedOcc 0
12 mol 112 unq 2 iso 0 dist 9.43616 9.64908 4.69658 10.746 7.71338 6.87434 6.13615 8.47988 5.92828 6.95317 numMergedOcc 0
13 mol 112 unq 3 iso 0 dist 9.43616 9.64908 4.69658 10.746 7.71338 6.87434 4.49971 8.0427 9.1247 7.57713 numMergedOcc 0
14 mol 143 unq 0 iso 0 dist 7.5984 5.33772 6.75249 5.11989 5.99315 8.64905 7.11802 5.40637 6.60366 7.39837 numMergedOcc 0
15 mol 205 unq 0 iso 0 dist 6.57849 8.83628 4.69695 14.3203 13.4269 9.31158 6.31671 8.4844 7.68686 8.97813 numMergedOcc 0
16 mol 228 unq 0 iso 0 dist 9.4597 6.9196 4.34361 5.85714 12.0155 9.25785 11.5135 12.5474 8.92379 9.3302 numMergedOcc 0
17 mol 228 unq 1 iso 0 dist 9.29603 6.72203 3.83677 5.79543 11.6303 9.01231 11.5792 12.0371 9.06403 9.39743 numMergedOcc 0
18 mol 253 unq 0 iso 0 dist 7.80525 9.80396 12.4657 6.27022 11.6434 8.94786 12.9816 19.3362 9.454 10.1605 numMergedOcc 0
19 mol 253 unq 1 iso 0 dist 7.71295 9.80396 8.57513 6.27022 6.73034 8.94786 12.9816 14.9259 9.454 10.1605 numMergedOcc 0
20 mol 277 unq 0 iso 0 dist 9.84188 4.1545 13.7583 10.4297 17.7135 7.42932 6.65084 13.3371 5.13533 4.40029 numMergedOcc 0
21 mol 277 unq 1 iso 0 dist 9.84188 4.1545 13.7583 5.77904 12.5685 4.9764 6.65084 13.3371 5.13533 3.97543 numMergedOcc 0
22 mol 277 unq 2 iso 0 dist 8.35794 4.1545 11.8607 10.4297 16.3537 7.42932 6.65084 12.1398 5.13533 4.40029 numMergedOcc 0
23 mol 277 unq 3 iso 0 dist 8.35794 4.1545 11.8607 5.77904 9.7748 4.9764 6.65084 12.1398 5.13533 3.97543 numMergedOcc 0
