0 mol 10 unq 0 iso 0 dist 9.09015 10.2264 8.3613 7.70383 3.3748 9.33141 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 7.82815 9.20224 8.3613 10.1589 3.3748 9.33141 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 7.70383 10.2264 9.33141 9.09015 3.3748 8.3613 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 5.56531 4.80143 8.01262 10.2154 13.3327 6.58046 numMergedOcc 0
4 mol 24 unq 0 iso 0 dist 9.74777 5.92191 7.49157 12.0552 4.10458 7.73794 numMergedOcc 0
5 mol 24 unq 1 iso 0 dist 9.7649 17.7515 8.23075 15.5956 6.0925 4.7841 numMergedOcc 0
6 mol 24 unq 2 iso 0 dist 6.5268 14.2153 8.23075 12.6101 6.0925 4.7841 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 7.31881 6.77896 9.58351 12.1183 8.81968 9.83836 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 6.29267 4.98967 5.25027 8.85201 5.30569 4.37025 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 6.56288 7.72238 7.69926 5.97559 2.58673 5.85237 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 5.97559 7.72238 5.85237 6.56288 2.58673 7.69926 numMergedOcc 0
11 mol 109 unq 0 iso 0 dist 8.71568 10.6579 7.44558 15.0386 9.99088 8.11702 numMergedOcc 0
12 mol 109 unq 1 iso 0 dist 5.81859 6.24368 7.44558 12.547 9.99088 8.11702 numMergedOcc 0
13 mol 111 unq 0 iso 0 dist 8.51084 4.41283 9.06601 5.53271 8.72808 5.98809 numMergedOcc 0
14 mol 111 unq 1 iso 0 dist 5.53271 4.41283 5.98809 8.51084 8.72808 9.06601 numMergedOcc 0
15 mol 117 unq 0 iso 0 dist 8.03867 10.6596 7.42146 14.2781 9.77711 7.78789 numMergedOcc 0
16 mol 117 unq 1 iso 0 dist 5.94465 6.3368 7.42146 12.5497 9.77711 7.78789 numMergedOcc 0
17 mol 120 unq 0 iso 0 dist 5.56598 5.6257 7.53694 9.65403 5.26524 8.38358 numMergedOcc 0
18 mol 120 unq 1 iso 0 dist 5.39792 5.0256 7.53694 8.44206 5.26524 8.38358 numMergedOcc 0
19 mol 120 unq 2 iso 0 dist 8.44206 5.0256 8.38358 5.39792 5.26524 7.53694 numMergedOcc 0
20 mol 120 unq 3 iso 0 dist 7.00542 8.66137 7.53694 9.78884 5.26524 8.38358 numMergedOcc 0
21 mol 120 unq 4 iso 0 dist 9.78884 8.66137 8.38358 7.00542 5.26524 7.53694 numMergedOcc 0
22 mol 147 unq 0 iso 0 dist 8.94352 6.97147 6.73617 11.8316 3.6066 9.03544 numMergedOcc 0
23 mol 218 unq 0 iso 0 dist 9.08818 6.75711 6.1896 11.1546 6.94905 6.09255 numMergedOcc 0
24 mol 253 unq 0 iso 0 dist 8.58013 7.40932 9.19385 14.0573 11.5519 7.14243 numMergedOcc 0
25 mol 253 unq 1 iso 0 dist 8.58013 7.40932 9.19385 12.9595 13.6905 5.77511 numMergedOcc 0
26 mol 253 unq 2 iso 0 dist 8.58013 7.40932 9.19385 14.9758 15.953 7.81382 numMergedOcc 0
27 mol 253 unq 3 iso 0 dist 8.58013 10.9466 9.1927 12.7759 6.8233 8.94786 numMergedOcc 0
28 mol 253 unq 4 iso 0 dist 8.58013 10.9466 9.1927 14.0573 11.5519 9.60694 numMergedOcc 0
29 mol 253 unq 5 iso 0 dist 8.58013 10.9466 9.1927 12.9595 13.6905 9.27311 numMergedOcc 0
30 mol 274 unq 0 iso 0 dist 9.89615 15.8358 8.12739 11.6437 5.57024 6.09853 numMergedOcc 0
31 mol 274 unq 1 iso 0 dist 5.77565 4.68199 8.12739 6.32853 5.57024 6.09853 numMergedOcc 0
32 mol 274 unq 2 iso 0 dist 6.32853 4.68199 6.09853 5.77565 5.57024 8.12739 numMergedOcc 0
33 mol 281 unq 0 iso 0 dist 9.05453 4.89583 5.50053 10.9079 3.77058 7.33334 numMergedOcc 0
34 mol 292 unq 0 iso 0 dist 9.15937 14.0055 9.96374 14.8283 8.12358 5.41432 numMergedOcc 0
