0 mol 26 unq 0 iso 0 dist 6.32127 9.77186 9.5053 11.0698 8.58071 9.41425 numMergedOcc 0
1 mol 28 unq 0 iso 0 dist 6.68029 5.63384 7.40415 13.075 10.4406 8.75468 numMergedOcc 0
2 mol 28 unq 1 iso 0 dist 6.68029 5.63384 7.40415 13.0341 12.0524 7.62989 numMergedOcc 0
3 mol 28 unq 2 iso 0 dist 6.68029 5.63384 7.40415 9.95766 10.0581 5.70238 numMergedOcc 0
4 mol 28 unq 3 iso 0 dist 6.44166 12.2072 7.40415 14.626 10.4406 8.75468 numMergedOcc 0
5 mol 28 unq 4 iso 0 dist 6.44166 12.2072 7.40415 17.0525 12.0524 7.62989 numMergedOcc 0
6 mol 28 unq 5 iso 0 dist 6.44166 12.2072 7.40415 16.1528 10.0581 5.70238 numMergedOcc 0
7 mol 90 unq 0 iso 0 dist 8.54821 7.4595 7.31784 7.45026 5.97902 9.08732 numMergedOcc 0
8 mol 105 unq 0 iso 0 dist 8.60172 8.60231 7.09806 16.2791 9.73765 9.09664 numMergedOcc 0
9 mol 141 unq 0 iso 0 dist 5.80081 6.27844 9.78667 5.35509 3.80087 8.88454 numMergedOcc 0
10 mol 141 unq 1 iso 0 dist 5.80081 6.2491 8.47026 5.35509 3.80087 9.48581 numMergedOcc 0
11 mol 141 unq 2 iso 0 dist 9.45931 12.0446 6.73983 12.9811 3.80763 8.88454 numMergedOcc 0
12 mol 141 unq 3 iso 0 dist 9.45931 15.1652 8.6387 12.9811 3.80763 9.48581 numMergedOcc 0
13 mol 141 unq 4 iso 0 dist 6.49728 6.27844 6.73983 5.35509 3.80763 8.88454 numMergedOcc 0
14 mol 141 unq 5 iso 0 dist 6.49728 6.2491 8.6387 5.35509 3.80763 9.48581 numMergedOcc 0
15 mol 141 unq 6 iso 0 dist 6.35397 12.0446 7.64956 12.9811 9.98068 8.88454 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 6.97467 7.94812 7.46845 6.10125 5.64188 5.22104 numMergedOcc 0
17 mol 182 unq 0 iso 0 dist 8.04856 9.14827 8.52103 7.01577 3.73864 8.62437 numMergedOcc 0
18 mol 182 unq 1 iso 0 dist 8.04856 9.14827 8.52103 10.243 3.85553 7.07405 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 9.47112 15.0925 9.17946 17.9371 13.6793 5.19567 numMergedOcc 0
20 mol 237 unq 0 iso 0 dist 6.78301 12.2119 6.07878 5.27463 4.50383 8.96803 numMergedOcc 0
21 mol 237 unq 1 iso 0 dist 6.78301 12.2119 6.07878 18.3271 11.9967 7.95072 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 7.06589 5.37783 8.15091 12.8601 10.4961 9.86765 numMergedOcc 0
23 mol 253 unq 1 iso 0 dist 7.06589 5.37783 8.15091 8.86676 5.68255 6.3738 numMergedOcc 0
24 mol 253 unq 2 iso 0 dist 8.70383 14.5125 8.15091 19.0922 10.4961 9.86765 numMergedOcc 0
25 mol 253 unq 3 iso 0 dist 8.70383 14.5125 8.15091 14.0165 5.68255 6.3738 numMergedOcc 0
26 mol 256 unq 0 iso 0 dist 5.17332 7.73529 9.66027 3.62582 3.70808 8.72093 numMergedOcc 0
