0 mol 2 unq 0 iso 0 dist 7.26738 9.3761 7.21955 5.59831 9.53758 11.4462 numMergedOcc 0
1 mol 6 unq 0 iso 0 dist 5.87959 7.76205 5.69098 5.21673 9.97675 11.5544 numMergedOcc 0
2 mol 30 unq 0 iso 0 dist 8.69758 7.92586 14.6477 5.66702 5.16345 13.3488 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.34858 9.72346 6.1032 5.71662 7.53564 10.7958 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 9.25184 7.51631 16.2547 13.3118 8.06263 18.2836 numMergedOcc 0
5 mol 120 unq 0 iso 0 dist 6.74094 4.7751 4.36262 6.78986 8.86071 9.35938 numMergedOcc 0
6 mol 120 unq 1 iso 0 dist 6.74094 4.7751 4.36262 10.2685 9.82087 10.8122 numMergedOcc 0
7 mol 142 unq 0 iso 0 dist 4.56239 6.4119 6.61855 5.20379 5.1557 5.79144 numMergedOcc 0
8 mol 142 unq 1 iso 0 dist 5.49328 8.40522 5.19808 11.3375 9.5355 5.79144 numMergedOcc 0
9 mol 156 unq 0 iso 0 dist 5.56994 8.08259 7.92829 6.02972 8.34508 9.15935 numMergedOcc 0
10 mol 174 unq 0 iso 0 dist 9.68082 7.43369 8.69056 9.44394 8.67807 14.0269 numMergedOcc 0
11 mol 174 unq 1 iso 0 dist 9.68082 6.85127 6.77289 9.44394 8.67807 12.3657 numMergedOcc 0
12 mol 180 unq 0 iso 0 dist 9.85529 5.70326 8.6624 10.7068 8.86377 12.9083 numMergedOcc 0
13 mol 180 unq 1 iso 0 dist 9.85529 5.70326 8.6624 13.984 8.47156 15.6271 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 8.69741 9.33393 10.9141 6.71673 6.32593 13.3213 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 9.20248 9.0495 9.04752 12.7518 4.21935 10.9363 numMergedOcc 0
16 mol 260 unq 0 iso 0 dist 8.69185 4.54064 5.76999 16.4987 8.66784 13.7488 numMergedOcc 0
17 mol 260 unq 1 iso 0 dist 8.69185 4.54064 5.76999 15.5171 8.3298 11.7903 numMergedOcc 0
18 mol 285 unq 0 iso 0 dist 9.20713 8.95073 3.46565 11.3632 8.78148 8.26827 numMergedOcc 0
19 mol 285 unq 1 iso 0 dist 9.20713 8.95073 3.46565 5.56783 8.33415 7.9002 numMergedOcc 0
