0 mol 1 unq 0 iso 0 dist 9.34725 6.41817 5.19589 7.16224 8.69605 6.2936 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 9.30501 6.41817 13.1116 7.16224 13.5303 6.2936 numMergedOcc 0
2 mol 17 unq 0 iso 0 dist 9.84064 8.84341 16.4709 11.3222 18.8778 6.80314 numMergedOcc 0
3 mol 17 unq 1 iso 0 dist 7.96836 7.02884 13.5569 5.21083 7.34681 6.80314 numMergedOcc 0
4 mol 17 unq 2 iso 0 dist 7.66522 8.84341 13.9821 11.3222 12.5763 6.80314 numMergedOcc 0
5 mol 17 unq 3 iso 0 dist 8.49309 7.02884 13.9821 5.21083 12.5763 6.80314 numMergedOcc 0
6 mol 26 unq 0 iso 0 dist 8.43571 6.32127 7.30207 7.39264 14.7384 8.98417 numMergedOcc 0
7 mol 53 unq 0 iso 0 dist 6.86092 5.66861 6.52918 4.79821 6.70095 8.5021 numMergedOcc 0
8 mol 87 unq 0 iso 0 dist 9.99609 7.14461 4.99645 8.37496 7.57471 8.59105 numMergedOcc 0
9 mol 87 unq 1 iso 0 dist 7.08616 7.14461 10.6701 8.37496 14.4469 8.59105 numMergedOcc 0
10 mol 87 unq 2 iso 0 dist 7.83182 7.14461 7.79329 8.37496 11.9046 8.59105 numMergedOcc 0
11 mol 92 unq 0 iso 0 dist 7.75977 8.57012 4.92054 10.7488 8.15664 8.96747 numMergedOcc 0
12 mol 103 unq 0 iso 0 dist 7.68908 6.87901 10.3138 6.38018 13.9046 9.6403 numMergedOcc 0
13 mol 103 unq 1 iso 0 dist 7.95587 6.87901 8.49357 6.38018 13.1481 9.6403 numMergedOcc 0
14 mol 116 unq 0 iso 0 dist 9.09071 7.85045 10.5909 9.9965 17.181 8.03113 numMergedOcc 0
15 mol 116 unq 1 iso 0 dist 9.09071 7.85045 10.5909 5.73517 6.53824 9.2638 numMergedOcc 0
16 mol 116 unq 2 iso 0 dist 7.7367 7.85045 6.2875 9.9965 13.5882 8.03113 numMergedOcc 0
17 mol 116 unq 3 iso 0 dist 7.7367 7.85045 6.2875 5.73517 6.61973 9.2638 numMergedOcc 0
18 mol 162 unq 0 iso 0 dist 8.80787 9.90113 5.81787 13.7363 11.8375 6.80226 numMergedOcc 0
19 mol 188 unq 0 iso 0 dist 7.82113 9.0939 10.2716 4.07548 8.1907 6.47305 numMergedOcc 0
20 mol 188 unq 1 iso 0 dist 7.82113 6.1338 5.01686 4.07548 8.1907 6.20426 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 8.96503 9.47112 4.79372 4.79799 5.86839 6.23057 numMergedOcc 0
22 mol 254 unq 0 iso 0 dist 9.61808 9.00866 6.5652 8.38548 11.4862 7.28781 numMergedOcc 0
23 mol 254 unq 1 iso 0 dist 9.61808 9.00866 6.5652 4.61312 10.683 7.00841 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 8.19595 5.9131 3.93924 9.49668 6.69245 8.86801 numMergedOcc 0
25 mol 272 unq 1 iso 0 dist 8.19595 5.9131 3.93924 4.36153 7.90763 7.15093 numMergedOcc 0
26 mol 272 unq 2 iso 0 dist 4.87063 8.16917 4.49309 13.1454 11.16 8.86801 numMergedOcc 0
27 mol 272 unq 3 iso 0 dist 4.87063 8.16917 4.49309 13.7982 11.2624 7.15093 numMergedOcc 0
28 mol 272 unq 4 iso 0 dist 8.56255 8.16917 3.93924 13.1454 6.69245 8.86801 numMergedOcc 0
29 mol 272 unq 5 iso 0 dist 8.56255 8.16917 3.93924 13.7982 7.90763 7.15093 numMergedOcc 0
