0 mol 56 unq 0 iso 0 dist 8.25594 6.34748 11.1062 15.6547 9.03564 19.296 12.0466 8.77529 13.0348 9.96534 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 5.82056 7.69222 3.32668 4.30874 5.5087 8.62198 5.75925 8.46627 10.7236 6.41115 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 5.82056 7.69222 3.32668 6.97502 5.61588 6.45841 5.75925 8.46627 10.7236 5.9144 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 5.82056 9.09115 5.30471 4.30874 5.5087 6.08682 5.75925 8.46627 9.22208 6.41115 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 5.82056 9.09115 5.30471 6.97502 5.61588 7.83244 5.75925 8.46627 9.22208 5.9144 numMergedOcc 0
5 mol 73 unq 4 iso 0 dist 9.09115 7.69222 8.07648 4.30874 6.08682 8.62198 5.75925 9.22208 10.7236 6.41115 numMergedOcc 0
6 mol 73 unq 5 iso 0 dist 9.09115 7.69222 8.07648 6.97502 7.83244 6.45841 5.75925 9.22208 10.7236 5.9144 numMergedOcc 0
7 mol 73 unq 6 iso 0 dist 9.09115 5.82056 5.30471 4.30874 6.08682 5.5087 5.75925 9.22208 8.46627 6.41115 numMergedOcc 0
8 mol 73 unq 7 iso 0 dist 9.09115 5.82056 5.30471 6.97502 7.83244 5.61588 5.75925 9.22208 8.46627 5.9144 numMergedOcc 0
9 mol 130 unq 0 iso 0 dist 7.15213 8.86516 3.69499 7.49673 6.93139 10.5849 5.23445 7.5573 9.58633 7.21225 numMergedOcc 0
10 mol 225 unq 0 iso 0 dist 7.50697 8.94981 13.7858 6.89798 8.14831 6.50998 10.685 6.46405 12.7232 6.28241 numMergedOcc 0
11 mol 225 unq 1 iso 0 dist 7.50697 5.90986 11.2712 6.89798 8.14831 9.09424 10.685 6.46405 13.9849 6.28241 numMergedOcc 0
12 mol 238 unq 0 iso 0 dist 9.67281 6.5311 13.167 7.01206 9.12776 9.3718 5.36582 4.66186 9.92058 5.71717 numMergedOcc 0
13 mol 238 unq 1 iso 0 dist 9.67281 6.5311 13.167 11.2453 9.72188 13.9517 5.36582 4.66186 9.92058 10.4706 numMergedOcc 0
14 mol 251 unq 0 iso 0 dist 6.17824 5.62261 3.63976 5.99541 9.82601 10.322 12.3351 9.02417 12.5936 13.28 numMergedOcc 0
15 mol 251 unq 1 iso 0 dist 6.17824 5.62261 3.63976 6.33949 6.50357 7.39775 12.3351 9.02417 12.5936 11.5298 numMergedOcc 0
16 mol 272 unq 0 iso 0 dist 8.45524 9.79769 5.18071 8.26567 6.44147 11.2228 5.72387 8.55539 12.2653 4.03396 numMergedOcc 0
17 mol 272 unq 1 iso 0 dist 8.45524 9.66055 9.5745 8.26567 6.44147 11.4951 5.72387 8.55539 11.7203 4.03396 numMergedOcc 0
18 mol 273 unq 0 iso 0 dist 6.95569 8.66133 15.0189 11.0966 6.31969 18.8091 9.73521 9.02537 13.0213 10.2693 numMergedOcc 0
19 mol 277 unq 0 iso 0 dist 9.91103 7.0603 3.39114 16.3552 9.57499 11.4389 6.65084 7.16209 4.62936 11.2997 numMergedOcc 0
20 mol 277 unq 1 iso 0 dist 9.91103 7.0603 3.39114 10.4297 5.46926 5.13913 6.65084 7.16209 4.62936 4.40029 numMergedOcc 0
21 mol 277 unq 2 iso 0 dist 9.91103 7.0603 3.39114 5.77904 8.9682 6.92711 6.65084 7.16209 4.62936 3.97543 numMergedOcc 0
22 mol 277 unq 3 iso 0 dist 7.0603 9.91103 3.39114 10.4297 5.13913 5.46926 6.65084 4.62936 7.16209 4.40029 numMergedOcc 0
23 mol 277 unq 4 iso 0 dist 7.0603 9.91103 3.39114 5.77904 6.92711 8.9682 6.65084 4.62936 7.16209 3.97543 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 7.32002 6.78424 3.52904 10.9431 9.74118 12.7664 5.1002 6.22943 8.1635 5.94 numMergedOcc 0
25 mol 292 unq 1 iso 0 dist 7.32002 6.78424 3.52904 10.9431 9.74118 12.7664 7.99979 9.31056 10.8907 9.18492 numMergedOcc 0
