0 mol 12 unq 0 iso 0 dist 7.4036 6.50215 7.92714 10.8946 6.55567 9.8142 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.5377 4.03395 8.0543 11.2087 6.64571 9.42876 numMergedOcc 0
2 mol 53 unq 0 iso 0 dist 5.80996 6.58374 8.94227 12.258 10.4706 8.19958 numMergedOcc 0
3 mol 53 unq 1 iso 0 dist 5.66861 8.93925 8.94227 13.3706 10.4706 8.19958 numMergedOcc 0
4 mol 54 unq 0 iso 0 dist 5.0478 6.85941 9.17082 7.18148 10.1455 8.75957 numMergedOcc 0
5 mol 91 unq 0 iso 0 dist 7.74952 3.98211 8.66165 10.0227 5.21888 9.97813 numMergedOcc 0
6 mol 91 unq 1 iso 0 dist 8.99674 12.4705 8.66165 14.2094 5.21888 9.97813 numMergedOcc 0
7 mol 116 unq 0 iso 0 dist 7.85045 7.3393 8.38606 10.8079 4.13755 8.58308 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 5.80081 11.3904 9.83945 5.35509 3.80087 9.59109 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 9.45931 7.98447 6.75376 12.9811 3.80763 9.59109 numMergedOcc 0
10 mol 141 unq 2 iso 0 dist 6.49728 11.3904 6.75376 5.35509 3.80763 9.59109 numMergedOcc 0
11 mol 141 unq 3 iso 0 dist 6.35397 7.98447 9.10042 12.9811 9.98068 9.59109 numMergedOcc 0
12 mol 184 unq 0 iso 0 dist 5.11863 6.2568 7.54099 7.79098 4.12242 7.02762 numMergedOcc 0
13 mol 184 unq 1 iso 0 dist 5.92785 9.41221 7.54099 6.30144 4.12242 7.02762 numMergedOcc 0
14 mol 256 unq 0 iso 0 dist 5.17332 5.05199 4.98734 3.62582 3.70808 6.63831 numMergedOcc 0
15 mol 256 unq 1 iso 0 dist 5.17332 5.05199 4.98734 12.0378 7.27053 9.23909 numMergedOcc 0
16 mol 256 unq 2 iso 0 dist 5.17332 5.9572 6.37963 3.62582 3.70808 8.08629 numMergedOcc 0
17 mol 256 unq 3 iso 0 dist 5.17332 10.1811 8.16803 3.62582 3.70808 9.03979 numMergedOcc 0
18 mol 256 unq 4 iso 0 dist 8.95444 9.21273 6.33496 15.3281 10.03 6.63831 numMergedOcc 0
19 mol 256 unq 5 iso 0 dist 8.95444 9.21273 6.33496 13.0404 4.26681 9.23909 numMergedOcc 0
20 mol 256 unq 6 iso 0 dist 8.95444 7.94816 6.00636 15.3281 10.03 8.08629 numMergedOcc 0
21 mol 256 unq 7 iso 0 dist 8.95444 9.60388 7.81448 13.0404 4.26681 9.16597 numMergedOcc 0
22 mol 256 unq 8 iso 0 dist 7.53508 11.5159 6.33496 15.8914 10.03 6.63831 numMergedOcc 0
23 mol 256 unq 9 iso 0 dist 7.53508 11.5159 6.33496 7.212 4.26681 9.23909 numMergedOcc 0
24 mol 256 unq 10 iso 0 dist 7.53508 12.9357 6.00636 15.8914 10.03 8.08629 numMergedOcc 0
25 mol 256 unq 11 iso 0 dist 7.53508 4.03381 7.81448 7.212 4.26681 9.16597 numMergedOcc 0
26 mol 287 unq 0 iso 0 dist 5.62568 5.48793 6.95912 6.23874 5.9468 9.23152 numMergedOcc 0
27 mol 287 unq 1 iso 0 dist 8.82948 10.7234 6.95912 10.5202 5.9468 9.23152 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 5.62568 5.48793 6.95912 6.23874 5.9468 9.23152 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 8.82948 10.7234 6.95912 10.5202 5.9468 9.23152 numMergedOcc 0
30 mol 289 unq 0 iso 0 dist 5.62568 5.48793 6.95912 6.23874 5.9468 9.23152 numMergedOcc 0
31 mol 289 unq 1 iso 0 dist 8.82948 10.7234 6.95912 10.5202 5.9468 9.23152 numMergedOcc 0
