0 mol 28 unq 0 iso 0 dist 8.24316 4.3475 7.7871 6.76158 11.1346 8.53424 6.18197 13.3907 9.64948 5.42412 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.24316 4.3475 7.7871 7.423 10.8275 7.08766 6.18197 13.3907 9.64948 8.09862 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 8.24316 4.3475 7.7871 7.423 10.8275 7.08766 13.6562 14.0551 10.1805 8.97167 numMergedOcc 0
3 mol 28 unq 3 iso 0 dist 8.24316 4.3475 7.7871 5.89257 7.90018 4.82199 6.18197 13.3907 9.64948 8.89114 numMergedOcc 0
4 mol 28 unq 4 iso 0 dist 8.24316 4.3475 7.7871 5.89257 7.90018 4.82199 13.6562 14.0551 10.1805 8.8182 numMergedOcc 0
5 mol 48 unq 0 iso 0 dist 7.49678 11.6027 8.10222 14.0783 9.57893 8.14245 10.2633 9.366 3.72746 9.21776 numMergedOcc 0
6 mol 48 unq 1 iso 0 dist 7.49678 11.6027 8.10222 14.0783 9.57893 8.14245 5.37112 5.06188 6.4561 9.40291 numMergedOcc 0
7 mol 48 unq 2 iso 0 dist 7.49678 11.6027 8.10222 15.9127 12.6437 6.36817 10.2633 9.366 3.72746 6.89752 numMergedOcc 0
8 mol 48 unq 3 iso 0 dist 7.49678 11.6027 8.10222 13.1628 7.88988 4.17933 10.2633 9.366 3.72746 6.85843 numMergedOcc 0
9 mol 48 unq 4 iso 0 dist 7.49678 11.6027 8.10222 13.1628 7.88988 4.17933 5.37112 5.06188 6.4561 7.94814 numMergedOcc 0
10 mol 48 unq 5 iso 0 dist 7.49678 11.6027 8.10222 14.3835 8.00934 5.54893 5.37112 5.06188 6.4561 9.55632 numMergedOcc 0
11 mol 63 unq 0 iso 0 dist 9.1747 11.8271 6.89855 16.6397 9.54378 9.13228 21.8545 13.3867 12.6017 6.42443 numMergedOcc 0
12 mol 76 unq 0 iso 0 dist 8.08674 6.27527 5.91098 8.26805 11.6853 7.66068 4.77004 7.48127 8.58474 9.50939 numMergedOcc 0
13 mol 76 unq 1 iso 0 dist 8.33694 6.27527 4.86523 8.26805 4.94673 7.66068 4.77004 11.1162 8.58474 9.50939 numMergedOcc 0
14 mol 90 unq 0 iso 0 dist 8.60438 4.3421 8.63446 7.30934 4.77556 5.24346 9.63545 9.06641 6.65219 7.01987 numMergedOcc 0
15 mol 143 unq 0 iso 0 dist 7.88346 6.03327 5.33772 5.24882 5.08025 4.3855 5.57673 5.40826 3.66518 6.38786 numMergedOcc 0
16 mol 254 unq 0 iso 0 dist 8.22257 15.6949 9.84028 13.7356 11.2466 9.20109 13.2505 12.9967 9.72134 7.40957 numMergedOcc 0
17 mol 256 unq 0 iso 0 dist 9.34785 9.39816 6.33954 13.9175 6.51471 5.58222 6.09764 6.45473 5.16057 9.49634 numMergedOcc 0
18 mol 266 unq 0 iso 0 dist 9.51286 4.58167 6.48382 6.9943 5.79323 6.96692 4.80695 9.62494 4.39553 9.90506 numMergedOcc 0
19 mol 266 unq 1 iso 0 dist 9.51286 4.58167 6.48382 6.9943 5.79323 6.96692 4.47412 10.0796 3.94797 9.03341 numMergedOcc 0
20 mol 266 unq 2 iso 0 dist 9.51286 4.58167 6.48382 7.36685 7.52317 8.25286 8.13583 9.0836 7.63149 6.39822 numMergedOcc 0
21 mol 266 unq 3 iso 0 dist 9.51286 4.58167 6.48382 7.36685 7.52317 8.25286 4.80695 9.62494 4.39553 8.61077 numMergedOcc 0
22 mol 266 unq 4 iso 0 dist 9.51286 4.58167 6.48382 9.03099 9.52953 9.9965 8.13583 9.0836 7.63149 5.36518 numMergedOcc 0
23 mol 266 unq 5 iso 0 dist 9.51286 4.58167 6.48382 9.03099 9.52953 9.9965 4.80695 9.62494 4.39553 9.11585 numMergedOcc 0
24 mol 266 unq 6 iso 0 dist 5.59641 8.51059 7.36137 14.5995 13.1028 8.25286 19.2822 18.3104 15.2892 7.74133 numMergedOcc 0
25 mol 266 unq 7 iso 0 dist 5.59641 7.79913 4.95415 14.5995 13.1028 9.9965 19.2822 18.3104 16.6916 7.74133 numMergedOcc 0
26 mol 277 unq 0 iso 0 dist 6.92271 9.69757 4.1545 7.34927 5.11865 7.98956 4.00063 8.15119 9.21484 9.07744 numMergedOcc 0
27 mol 277 unq 1 iso 0 dist 6.92271 9.69757 4.1545 7.34927 5.11865 7.98956 13.5537 9.29402 7.73174 8.42892 numMergedOcc 0
28 mol 277 unq 2 iso 0 dist 6.92271 9.69757 4.1545 7.34927 5.11865 7.98956 12.5125 13.5254 16.883 8.90967 numMergedOcc 0
29 mol 277 unq 3 iso 0 dist 6.92271 10.2113 4.25172 7.34927 5.11865 5.86185 4.00063 8.15119 10.3506 9.07744 numMergedOcc 0
30 mol 277 unq 4 iso 0 dist 6.92271 10.2113 4.25172 7.34927 5.11865 5.86185 13.5537 9.29402 5.42115 8.42892 numMergedOcc 0
31 mol 277 unq 5 iso 0 dist 6.92271 10.2113 4.25172 7.34927 5.11865 5.86185 12.5125 13.5254 14.5363 8.90967 numMergedOcc 0
32 mol 277 unq 6 iso 0 dist 8.62666 7.55695 4.1545 7.54315 5.11865 7.98956 9.31316 8.15119 9.21484 9.07744 numMergedOcc 0
33 mol 277 unq 7 iso 0 dist 8.62666 7.55695 4.1545 7.54315 5.11865 7.98956 4.15308 9.29402 7.73174 8.42892 numMergedOcc 0
34 mol 277 unq 8 iso 0 dist 8.62666 7.55695 4.1545 7.54315 5.11865 7.98956 14.7276 13.5254 16.883 8.90967 numMergedOcc 0
35 mol 277 unq 9 iso 0 dist 8.62666 6.26644 4.25172 7.54315 5.11865 5.86185 9.31316 8.15119 10.3506 9.07744 numMergedOcc 0
36 mol 277 unq 10 iso 0 dist 8.62666 6.26644 4.25172 7.54315 5.11865 5.86185 4.15308 9.29402 5.42115 8.42892 numMergedOcc 0
37 mol 277 unq 11 iso 0 dist 8.62666 6.26644 4.25172 7.54315 5.11865 5.86185 14.7276 13.5254 14.5363 8.90967 numMergedOcc 0
