0 mol 25 unq 0 iso 0 dist 9.26381 4.32034 7.05148 10.4654 6.17631 8.6653 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 9.26381 4.32034 7.05148 11.2792 5.59268 7.92503 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 5.35101 4.7391 5.84625 9.74058 5.40367 8.80614 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 8.68381 4.35705 5.84625 12.818 5.40367 8.80614 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 7.64177 9.54278 8.2746 10.2072 4.47138 7.56205 numMergedOcc 0
5 mol 62 unq 1 iso 0 dist 7.64177 9.54278 8.2746 14.041 10.9596 4.74544 numMergedOcc 0
6 mol 62 unq 2 iso 0 dist 7.92027 6.71938 8.2746 6.56664 4.47138 7.56205 numMergedOcc 0
7 mol 62 unq 3 iso 0 dist 7.92027 6.71938 8.2746 9.58156 10.9596 4.74544 numMergedOcc 0
8 mol 62 unq 4 iso 0 dist 6.08756 5.31715 8.2746 7.99003 4.47138 7.56205 numMergedOcc 0
9 mol 62 unq 5 iso 0 dist 6.08756 5.31715 8.2746 9.89555 10.9596 4.74544 numMergedOcc 0
10 mol 91 unq 0 iso 0 dist 7.62621 5.75219 5.51406 8.00525 10.2967 9.30539 numMergedOcc 0
11 mol 113 unq 0 iso 0 dist 8.28452 5.58964 5.37302 8.29529 14.0364 9.66219 numMergedOcc 0
12 mol 113 unq 1 iso 0 dist 8.44004 12.297 5.37302 18.9382 14.0364 9.66219 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 9.22456 8.11294 9.04845 12.8006 14.5617 6.16242 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 9.22456 8.11294 9.04845 9.73536 13.7612 5.87634 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 5.7232 8.11294 6.72323 12.8006 10.2385 6.16242 numMergedOcc 0
16 mol 133 unq 3 iso 0 dist 5.7232 8.11294 6.72323 9.73536 4.64588 5.87634 numMergedOcc 0
17 mol 141 unq 0 iso 0 dist 8.0302 6.13227 8.01453 12.2525 5.91683 9.87644 numMergedOcc 0
18 mol 141 unq 1 iso 0 dist 6.65051 5.50161 8.01453 11.4589 5.91683 9.87644 numMergedOcc 0
19 mol 141 unq 2 iso 0 dist 9.41519 9.59112 8.01453 14.5087 5.91683 9.87644 numMergedOcc 0
20 mol 146 unq 0 iso 0 dist 5.3184 9.68961 7.13378 12.3208 8.76758 8.84535 numMergedOcc 0
21 mol 146 unq 1 iso 0 dist 5.3184 9.68961 7.13378 11.4896 6.347 8.82188 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 8.94464 6.15536 9.07527 9.50454 9.32503 5.9176 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 8.63713 10.5886 8.63119 7.15963 4.98009 8.90963 numMergedOcc 0
24 mol 197 unq 0 iso 0 dist 7.91999 5.9589 7.40027 9.14737 5.29309 6.92924 numMergedOcc 0
25 mol 243 unq 0 iso 0 dist 8.93292 4.35114 8.55613 10.8463 11.7757 7.49645 numMergedOcc 0
26 mol 243 unq 1 iso 0 dist 8.93292 4.35114 8.55613 11.4641 11.9474 9.9222 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 8.62592 12.2121 8.63176 14.862 8.27707 9.63959 numMergedOcc 0
28 mol 258 unq 1 iso 0 dist 8.62592 12.2121 8.63176 20.5137 13.5559 9.96262 numMergedOcc 0
29 mol 258 unq 2 iso 0 dist 8.62592 12.2121 8.63176 11.1218 6.48867 7.21311 numMergedOcc 0
