0 mol 0 unq 0 iso 0 dist 6.28506 7.79297 5.14913 6.73401 11.2223 9.67081 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.42607 6.49709 5.8961 4.4067 11.7765 8.68293 numMergedOcc 0
2 mol 11 unq 1 iso 0 dist 9.42607 6.49709 5.8961 13.2938 9.07476 6.84216 numMergedOcc 0
3 mol 11 unq 2 iso 0 dist 6.20956 6.49709 4.73237 4.4067 6.09937 8.68293 numMergedOcc 0
4 mol 11 unq 3 iso 0 dist 6.20956 6.49709 4.73237 13.2938 9.94905 6.84216 numMergedOcc 0
5 mol 18 unq 0 iso 0 dist 9.4649 5.32149 10.4194 4.86477 11.3419 9.1397 numMergedOcc 0
6 mol 18 unq 1 iso 0 dist 6.45965 5.32149 6.47139 4.86477 6.09533 9.1397 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.32868 9.96446 9.29076 12.0126 11.1082 5.42067 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 7.32868 6.70686 4.39652 12.0126 11.1082 7.36435 numMergedOcc 0
9 mol 95 unq 0 iso 0 dist 9.35364 7.90775 15.7022 6.56529 15.4974 7.51733 numMergedOcc 0
10 mol 122 unq 0 iso 0 dist 8.3907 8.47907 4.42285 12.1473 6.80798 4.42563 numMergedOcc 0
11 mol 154 unq 0 iso 0 dist 9.71025 6.44195 5.88662 5.71332 8.26128 8.89394 numMergedOcc 0
12 mol 163 unq 0 iso 0 dist 9.04436 7.75045 4.12904 11.5774 11.9872 9.90947 numMergedOcc 0
13 mol 163 unq 1 iso 0 dist 9.04436 7.75045 4.12904 10.9436 9.37245 8.16252 numMergedOcc 0
14 mol 167 unq 0 iso 0 dist 9.08229 6.53913 5.48405 5.60897 6.10021 5.36671 numMergedOcc 0
15 mol 167 unq 1 iso 0 dist 7.99057 6.53913 10.8859 5.60897 11.0561 5.36671 numMergedOcc 0
16 mol 169 unq 0 iso 0 dist 9.19569 6.28961 4.34424 12.9917 9.58901 9.37946 numMergedOcc 0
17 mol 169 unq 1 iso 0 dist 9.19569 6.28961 4.34424 12.2955 12.3909 9.13646 numMergedOcc 0
18 mol 169 unq 2 iso 0 dist 9.19569 6.28961 4.34424 11.6543 11.8557 8.34216 numMergedOcc 0
19 mol 195 unq 0 iso 0 dist 5.7709 4.78641 5.90604 4.65343 9.88738 6.59544 numMergedOcc 0
20 mol 197 unq 0 iso 0 dist 8.22331 6.18446 7.56497 9.33865 14.0133 9.23086 numMergedOcc 0
21 mol 205 unq 0 iso 0 dist 5.91079 6.11505 4.78067 13.9601 13.0087 9.31158 numMergedOcc 0
22 mol 237 unq 0 iso 0 dist 5.73318 9.59483 4.51174 18.1875 13.3452 9.14911 numMergedOcc 0
23 mol 285 unq 0 iso 0 dist 9.33149 9.82717 4.16039 13.5711 9.59733 6.71946 numMergedOcc 0
24 mol 285 unq 1 iso 0 dist 9.33149 9.82717 4.16039 17.9142 9.51087 8.28061 numMergedOcc 0
25 mol 285 unq 2 iso 0 dist 9.33149 9.82717 4.16039 13.8352 5.28731 5.03601 numMergedOcc 0
26 mol 285 unq 3 iso 0 dist 5.77107 6.44657 4.16039 11.6832 9.59733 6.71946 numMergedOcc 0
27 mol 285 unq 4 iso 0 dist 5.77107 6.44657 4.16039 6.73715 9.51087 8.28061 numMergedOcc 0
28 mol 285 unq 5 iso 0 dist 5.77107 6.44657 4.16039 5.32175 5.28731 5.03601 numMergedOcc 0
