0 mol 20 unq 0 iso 0 dist 7.33632 6.81416 4.68566 6.98731 11.9031 8.72023 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.41865 6.87744 6.81213 10.4881 7.51406 5.69955 numMergedOcc 0
2 mol 26 unq 1 iso 0 dist 9.41865 6.87744 6.81213 10.4441 14.9006 8.6385 numMergedOcc 0
3 mol 30 unq 0 iso 0 dist 8.69758 6.40398 5.77009 10.9094 8.21595 8.7817 numMergedOcc 0
4 mol 30 unq 1 iso 0 dist 8.69758 6.40398 5.77009 11.8694 9.60744 7.55415 numMergedOcc 0
5 mol 38 unq 0 iso 0 dist 9.71979 9.46333 9.9891 5.45587 12.6794 7.57959 numMergedOcc 0
6 mol 43 unq 0 iso 0 dist 9.6521 9.17687 14.0747 14.4151 22.4977 9.93832 numMergedOcc 0
7 mol 43 unq 1 iso 0 dist 9.6521 9.17687 14.0747 10.3283 17.0579 8.60739 numMergedOcc 0
8 mol 70 unq 0 iso 0 dist 9.60641 9.33262 6.69775 9.9009 12.2091 9.31969 numMergedOcc 0
9 mol 70 unq 1 iso 0 dist 9.60641 9.33262 6.69775 9.66495 7.63663 6.54023 numMergedOcc 0
10 mol 70 unq 2 iso 0 dist 7.68652 4.67358 6.69775 9.17087 12.2091 9.31969 numMergedOcc 0
11 mol 70 unq 3 iso 0 dist 7.68652 4.67358 6.69775 5.33532 7.63663 6.54023 numMergedOcc 0
12 mol 70 unq 4 iso 0 dist 7.19617 9.33262 11.4467 9.9009 14.4139 9.31969 numMergedOcc 0
13 mol 70 unq 5 iso 0 dist 7.19617 9.33262 11.4467 9.66495 11.5775 6.54023 numMergedOcc 0
14 mol 134 unq 0 iso 0 dist 9.16832 5.8367 7.63527 11.9678 14.3281 7.36779 numMergedOcc 0
15 mol 134 unq 1 iso 0 dist 9.16832 5.8367 7.63527 13.0109 13.2555 8.20836 numMergedOcc 0
16 mol 209 unq 0 iso 0 dist 7.95916 6.43914 13.5381 5.35615 12.0618 8.41195 numMergedOcc 0
17 mol 230 unq 0 iso 0 dist 9.38925 6.47064 13.6071 10.7614 15.5293 9.09271 numMergedOcc 0
18 mol 230 unq 1 iso 0 dist 9.38925 6.47064 13.6071 11.777 18.5957 7.44838 numMergedOcc 0
19 mol 230 unq 2 iso 0 dist 8.71717 6.47064 14.5944 10.7614 18.0993 9.09271 numMergedOcc 0
20 mol 230 unq 3 iso 0 dist 8.71717 6.47064 14.5944 11.777 20.2843 7.44838 numMergedOcc 0
21 mol 239 unq 0 iso 0 dist 5.85061 8.74485 5.71442 6.80725 8.7017 8.67805 numMergedOcc 0
22 mol 261 unq 0 iso 0 dist 9.12695 5.67349 6.0813 4.63237 10.1373 5.26434 numMergedOcc 0
23 mol 261 unq 1 iso 0 dist 9.12695 5.67349 6.0813 6.39263 13.9801 8.60026 numMergedOcc 0
24 mol 272 unq 0 iso 0 dist 9.86454 9.00781 14.3774 9.92738 11.8058 9.05222 numMergedOcc 0
