0 mol 28 unq 0 iso 0 dist 8.24316 4.3475 7.7871 6.76158 11.1346 8.53424 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.24316 4.3475 7.7871 7.423 10.8275 7.08766 numMergedOcc 0
2 mol 28 unq 2 iso 0 dist 8.24316 4.3475 7.7871 5.89257 7.90018 4.82199 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 7.49678 11.6027 8.10222 14.0783 9.57893 8.14245 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 7.49678 11.6027 8.10222 15.9127 12.6437 6.36817 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 7.49678 11.6027 8.10222 18.2411 12.0687 8.0812 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 7.49678 11.6027 8.10222 13.1628 7.88988 4.17933 numMergedOcc 0
7 mol 48 unq 4 iso 0 dist 7.49678 11.6027 8.10222 14.3835 8.00934 5.54893 numMergedOcc 0
8 mol 63 unq 0 iso 0 dist 9.1747 11.8271 6.89855 11.3289 5.04771 8.14512 numMergedOcc 0
9 mol 63 unq 1 iso 0 dist 9.1747 11.8271 6.89855 16.6397 9.54378 9.13228 numMergedOcc 0
10 mol 68 unq 0 iso 0 dist 5.68303 3.97203 5.26566 6.82511 5.08181 7.7485 numMergedOcc 0
11 mol 76 unq 0 iso 0 dist 8.08674 6.27527 5.91098 8.26805 11.6853 7.66068 numMergedOcc 0
12 mol 76 unq 1 iso 0 dist 8.08674 6.27527 5.91098 9.68577 15.0489 9.5043 numMergedOcc 0
13 mol 76 unq 2 iso 0 dist 8.08674 6.27527 5.91098 11.3425 14.2393 8.34132 numMergedOcc 0
14 mol 76 unq 3 iso 0 dist 8.33694 6.27527 4.86523 8.26805 4.94673 7.66068 numMergedOcc 0
15 mol 76 unq 4 iso 0 dist 8.33694 6.27527 4.86523 9.68577 5.78236 9.5043 numMergedOcc 0
16 mol 76 unq 5 iso 0 dist 8.33694 6.27527 4.86523 11.3425 4.73151 8.34132 numMergedOcc 0
17 mol 90 unq 0 iso 0 dist 8.60438 4.3421 8.63446 7.30934 4.77556 5.24346 numMergedOcc 0
18 mol 93 unq 0 iso 0 dist 7.65028 7.0652 5.23929 10.7186 4.90515 5.20429 numMergedOcc 0
19 mol 93 unq 1 iso 0 dist 7.65028 7.0652 5.23929 6.06155 5.08254 8.71366 numMergedOcc 0
20 mol 98 unq 0 iso 0 dist 9.74889 5.90092 9.45257 5.91023 7.22521 6.5816 numMergedOcc 0
21 mol 122 unq 0 iso 0 dist 8.50192 7.92835 4.821 14.2154 5.74569 8.565 numMergedOcc 0
22 mol 143 unq 0 iso 0 dist 7.88346 6.03327 5.33772 5.24882 5.08025 4.3855 numMergedOcc 0
23 mol 214 unq 0 iso 0 dist 7.7874 14.6013 9.53899 14.1678 6.49466 7.42759 numMergedOcc 0
24 mol 254 unq 0 iso 0 dist 8.22257 15.6949 9.84028 15.6414 11.4342 7.85841 numMergedOcc 0
25 mol 254 unq 1 iso 0 dist 8.22257 15.6949 9.84028 13.7356 11.2466 9.20109 numMergedOcc 0
26 mol 256 unq 0 iso 0 dist 9.34785 9.39816 6.33954 13.9175 6.51471 5.58222 numMergedOcc 0
27 mol 260 unq 0 iso 0 dist 5.16772 4.38276 6.90472 7.13397 11.9315 8.62655 numMergedOcc 0
28 mol 266 unq 0 iso 0 dist 9.51286 4.58167 6.48382 6.9943 5.79323 6.96692 numMergedOcc 0
29 mol 266 unq 1 iso 0 dist 9.51286 4.58167 6.48382 7.36685 7.52317 8.25286 numMergedOcc 0
30 mol 266 unq 2 iso 0 dist 9.51286 4.58167 6.48382 9.03099 9.52953 9.9965 numMergedOcc 0
31 mol 266 unq 3 iso 0 dist 5.59641 8.51059 7.36137 15.2368 12.2408 7.8598 numMergedOcc 0
32 mol 266 unq 4 iso 0 dist 5.59641 8.51059 7.36137 14.5995 13.1028 8.25286 numMergedOcc 0
33 mol 266 unq 5 iso 0 dist 5.59641 7.79913 4.95415 15.2368 12.2408 7.80711 numMergedOcc 0
34 mol 266 unq 6 iso 0 dist 5.59641 7.79913 4.95415 14.5995 13.1028 9.9965 numMergedOcc 0
35 mol 277 unq 0 iso 0 dist 6.92271 9.69757 4.1545 7.34927 5.11865 7.98956 numMergedOcc 0
36 mol 277 unq 1 iso 0 dist 6.92271 10.2113 4.25172 7.34927 5.11865 5.86185 numMergedOcc 0
37 mol 277 unq 2 iso 0 dist 8.62666 7.55695 4.1545 7.54315 5.11865 7.98956 numMergedOcc 0
38 mol 277 unq 3 iso 0 dist 8.62666 6.26644 4.25172 7.54315 5.11865 5.86185 numMergedOcc 0
