0 mol 43 unq 0 iso 0 dist 9.0979 10.1001 6.66407 10.7173 9.50614 11.4153 11.7216 5.07458 5.73819 13.8936 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.0979 10.1001 6.66407 14.5812 8.34145 4.96926 11.7216 5.07458 5.73819 6.75943 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.25594 15.6547 9.03564 12.0466 8.77529 9.96534 14.6148 6.75591 8.66265 13.2483 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 5.82056 4.30874 5.5087 5.75925 8.46627 6.41115 11.6749 11.2069 8.70481 15.0347 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 9.09115 4.30874 6.08682 5.75925 9.22208 6.41115 11.6749 10.6713 8.70481 15.0347 numMergedOcc 0
5 mol 129 unq 0 iso 0 dist 9.71342 6.29782 5.58833 4.46925 8.25397 6.16616 10.514 9.00231 5.83384 11.8464 numMergedOcc 0
6 mol 129 unq 1 iso 0 dist 8.57774 5.99695 5.58833 6.57177 8.25397 6.16616 10.482 9.00231 5.83384 11.8464 numMergedOcc 0
7 mol 130 unq 0 iso 0 dist 9.67398 7.09664 6.93139 7.12852 7.5573 7.21225 9.05626 4.97996 8.70949 10.4778 numMergedOcc 0
8 mol 130 unq 1 iso 0 dist 7.15213 7.49673 6.93139 5.23445 7.5573 7.21225 11.7446 4.97996 8.70949 10.4778 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 9.7105 9.71227 7.22643 5.94578 7.48208 4.88025 7.15203 6.9945 8.22656 8.26547 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 9.7105 9.71227 7.22643 5.94578 7.48208 4.88025 11.0475 4.19723 6.82262 9.05342 numMergedOcc 0
11 mol 181 unq 0 iso 0 dist 8.39573 12.5935 9.01624 10.7348 9.92831 5.42158 13.3844 5.71898 7.81386 9.81178 numMergedOcc 0
12 mol 181 unq 1 iso 0 dist 8.39573 12.5935 9.01624 10.7348 9.92831 5.42158 9.63295 5.93724 7.63312 10.6106 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.67281 7.01206 9.12776 5.36582 4.66186 5.71717 13.8075 10.3162 7.31233 10.1172 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 9.67281 11.2453 9.72188 5.36582 4.66186 10.4706 11.7876 7.06793 5.72887 8.923 numMergedOcc 0
15 mol 272 unq 0 iso 0 dist 5.38409 4.78295 6.44147 8.40364 8.55539 4.03396 8.82094 5.12237 8.48753 10.3659 numMergedOcc 0
16 mol 272 unq 1 iso 0 dist 8.45524 8.26567 6.44147 5.72387 8.55539 4.03396 9.80332 5.12237 8.48753 10.3659 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 9.91103 5.77904 8.9682 6.65084 7.16209 3.97543 8.35794 17.6038 9.7748 12.1398 numMergedOcc 0
18 mol 277 unq 1 iso 0 dist 7.0603 5.77904 6.92711 6.65084 4.62936 3.97543 8.35794 14.772 9.7748 12.1398 numMergedOcc 0
