0 mol 8 unq 0 iso 0 dist 9.11545 10.9865 8.68949 12.928 9.31461 3.84732 16.8517 10.8849 9.42634 11.0838 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 9.83301 5.6382 5.52834 9.67906 7.53194 4.62559 7.73997 10.1829 9.39402 13.1561 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 7.49678 5.37112 5.06188 11.6027 8.10222 6.4561 14.0783 9.57893 9.40291 8.14245 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 7.49678 5.37112 5.06188 11.6027 8.10222 6.4561 13.1628 7.88988 7.94814 4.17933 numMergedOcc 0
4 mol 48 unq 2 iso 0 dist 7.49678 5.37112 5.06188 11.6027 8.10222 6.4561 14.3835 8.00934 9.55632 5.54893 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.08674 4.77004 7.48127 6.27527 5.91098 8.58474 8.26805 11.6853 9.50939 7.66068 numMergedOcc 0
6 mol 90 unq 0 iso 0 dist 8.60438 9.63545 9.06641 4.3421 8.63446 6.65219 7.30934 4.77556 7.01987 5.24346 numMergedOcc 0
7 mol 143 unq 0 iso 0 dist 7.88346 5.57673 5.40826 6.03327 5.33772 3.66518 11.6503 5.80693 9.31435 10.8164 numMergedOcc 0
8 mol 143 unq 1 iso 0 dist 7.88346 5.57673 5.40826 6.03327 5.33772 3.66518 5.24882 5.08025 6.38786 4.3855 numMergedOcc 0
9 mol 204 unq 0 iso 0 dist 9.12896 13.4281 9.52029 5.86531 9.41594 9.47121 18.1127 16.0878 8.98633 15.3367 numMergedOcc 0
10 mol 204 unq 1 iso 0 dist 9.12896 13.4281 9.52029 8.02399 9.92651 11.8097 18.1127 16.0878 8.98633 19.3267 numMergedOcc 0
11 mol 204 unq 2 iso 0 dist 8.63667 9.86864 9.52029 7.92458 9.41594 9.47121 11.8684 16.0878 8.98633 15.3367 numMergedOcc 0
12 mol 204 unq 3 iso 0 dist 8.63667 9.86864 9.52029 12.0632 9.92651 11.8097 11.8684 16.0878 8.98633 19.3267 numMergedOcc 0
13 mol 214 unq 0 iso 0 dist 7.7874 5.43552 4.36421 14.6013 9.53899 13.6384 14.9048 9.91172 9.96715 16.4793 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 7.04478 11.481 8.86185 3.34784 7.24545 13.8399 12.8938 6.16212 9.58325 12.9371 numMergedOcc 0
15 mol 256 unq 0 iso 0 dist 9.34785 6.09764 6.45473 9.39816 6.33954 5.16057 13.9175 6.51471 9.49634 5.58222 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 9.51286 8.13583 9.0836 4.58167 6.48382 7.63149 7.36685 7.52317 6.39822 8.25286 numMergedOcc 0
17 mol 266 unq 1 iso 0 dist 9.51286 8.13583 9.0836 4.58167 6.48382 7.63149 9.03099 9.52953 5.36518 9.9965 numMergedOcc 0
18 mol 266 unq 2 iso 0 dist 9.51286 4.80695 9.62494 4.58167 6.48382 4.39553 6.9943 5.79323 9.90506 6.96692 numMergedOcc 0
19 mol 266 unq 3 iso 0 dist 9.51286 4.80695 9.62494 4.58167 6.48382 4.39553 7.36685 7.52317 8.61077 8.25286 numMergedOcc 0
20 mol 266 unq 4 iso 0 dist 9.51286 4.80695 9.62494 4.58167 6.48382 4.39553 9.03099 9.52953 9.11585 9.9965 numMergedOcc 0
21 mol 277 unq 0 iso 0 dist 6.92271 4.00063 8.15119 9.69757 4.1545 9.21484 7.34927 5.11865 9.07744 7.98956 numMergedOcc 0
22 mol 277 unq 1 iso 0 dist 6.92271 4.00063 8.15119 10.2113 4.25172 10.3506 7.34927 5.11865 9.07744 5.86185 numMergedOcc 0
23 mol 277 unq 2 iso 0 dist 8.62666 9.31316 8.15119 7.55695 4.1545 9.21484 7.54315 5.11865 9.07744 7.98956 numMergedOcc 0
24 mol 277 unq 3 iso 0 dist 8.62666 9.31316 8.15119 6.26644 4.25172 10.3506 7.54315 5.11865 9.07744 5.86185 numMergedOcc 0
