0 mol 44 unq 0 iso 0 dist 9.52676 9.32021 7.03307 12.5937 5.25016 7.25707 numMergedOcc 0
1 mol 105 unq 0 iso 0 dist 8.60172 8.60231 7.09806 12.1578 6.37217 7.71923 numMergedOcc 0
2 mol 105 unq 1 iso 0 dist 8.60172 8.60231 7.09806 13.8102 5.73435 9.87821 numMergedOcc 0
3 mol 119 unq 0 iso 0 dist 9.10479 8.3604 7.91683 14.5417 12.3703 8.8562 numMergedOcc 0
4 mol 131 unq 0 iso 0 dist 8.74658 6.53994 5.56627 13.1409 5.37172 8.92828 numMergedOcc 0
5 mol 131 unq 1 iso 0 dist 8.74658 13.4383 8.50562 13.1409 5.37172 5.44303 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 9.14007 5.74529 6.94988 9.78937 6.51325 4.46777 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 5.80081 6.27844 9.78667 6.49728 6.33946 6.73983 numMergedOcc 0
8 mol 141 unq 2 iso 0 dist 5.80081 6.27844 9.78667 10.8969 12.8394 7.64956 numMergedOcc 0
9 mol 141 unq 3 iso 0 dist 5.80081 6.2491 8.47026 6.49728 6.33946 8.6387 numMergedOcc 0
10 mol 141 unq 4 iso 0 dist 9.45931 12.0446 6.73983 15.2357 6.33946 9.78667 numMergedOcc 0
11 mol 141 unq 5 iso 0 dist 9.45931 12.0446 6.73983 6.35397 6.59975 7.64956 numMergedOcc 0
12 mol 141 unq 6 iso 0 dist 9.45931 15.1652 8.6387 15.2357 6.33946 8.47026 numMergedOcc 0
13 mol 141 unq 7 iso 0 dist 6.49728 6.27844 6.73983 5.80081 6.33946 9.78667 numMergedOcc 0
14 mol 141 unq 8 iso 0 dist 6.49728 6.27844 6.73983 10.8969 6.59975 7.64956 numMergedOcc 0
15 mol 141 unq 9 iso 0 dist 6.49728 6.2491 8.6387 5.80081 6.33946 8.47026 numMergedOcc 0
16 mol 141 unq 10 iso 0 dist 6.35397 12.0446 7.64956 15.2357 12.8394 9.78667 numMergedOcc 0
17 mol 141 unq 11 iso 0 dist 6.35397 12.0446 7.64956 9.45931 6.59975 6.73983 numMergedOcc 0
18 mol 182 unq 0 iso 0 dist 8.04856 9.14827 8.52103 12.781 5.97071 8.2169 numMergedOcc 0
19 mol 186 unq 0 iso 0 dist 9.38735 5.26093 4.5271 8.89293 6.68665 7.02575 numMergedOcc 0
20 mol 186 unq 1 iso 0 dist 8.89293 5.26093 7.02575 9.38735 6.68665 4.5271 numMergedOcc 0
21 mol 222 unq 0 iso 0 dist 8.37652 7.45292 8.88664 11.2537 6.85131 9.08955 numMergedOcc 0
22 mol 222 unq 1 iso 0 dist 8.37652 7.45292 8.88664 10.132 4.19322 7.16819 numMergedOcc 0
23 mol 226 unq 0 iso 0 dist 9.20651 11.576 6.26945 12.1968 9.75764 6.37744 numMergedOcc 0
24 mol 237 unq 0 iso 0 dist 6.78301 12.2119 6.07878 11.3111 5.62416 7.80422 numMergedOcc 0
25 mol 237 unq 1 iso 0 dist 6.78301 12.2119 6.07878 15.258 8.65228 5.06628 numMergedOcc 0
