0 mol 0 unq 0 iso 0 dist 7.79297 16.4903 9.19007 13.5785 6.0225 6.94943 numMergedOcc 0
1 mol 7 unq 0 iso 0 dist 9.20552 6.49868 7.88043 14.4965 12.8323 8.15894 numMergedOcc 0
2 mol 7 unq 1 iso 0 dist 9.20552 8.07954 8.80762 14.4965 12.8323 8.45544 numMergedOcc 0
3 mol 26 unq 0 iso 0 dist 8.90473 10.0227 8.6385 11.6641 7.73394 6.73167 numMergedOcc 0
4 mol 26 unq 1 iso 0 dist 8.90473 10.0227 8.6385 13.3268 7.42064 7.40948 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 6.84521 10.0977 8.44903 10.8355 4.96926 7.15901 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 5.84326 8.45716 8.63486 7.07124 6.15355 5.07125 numMergedOcc 0
7 mol 98 unq 0 iso 0 dist 9.83528 5.90298 7.26086 11.8912 3.9764 8.75597 numMergedOcc 0
8 mol 98 unq 1 iso 0 dist 7.54969 8.8736 7.26086 8.79016 3.9764 8.75597 numMergedOcc 0
9 mol 178 unq 0 iso 0 dist 8.04723 5.24118 4.92088 10.9114 6.42973 8.25282 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 9.52413 12.1191 9.83476 11.1116 13.6744 7.04815 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 9.52413 12.1191 9.83476 15.9217 15.0914 6.07389 numMergedOcc 0
12 mol 188 unq 0 iso 0 dist 7.24099 6.77718 8.57261 13.0489 9.71636 7.79115 numMergedOcc 0
13 mol 195 unq 0 iso 0 dist 7.39185 9.67099 6.60567 10.1071 5.41635 6.34234 numMergedOcc 0
14 mol 195 unq 1 iso 0 dist 7.39185 9.67099 6.60567 17.3106 11.9954 7.87972 numMergedOcc 0
15 mol 195 unq 2 iso 0 dist 4.78641 9.33058 6.60567 6.27266 5.41635 6.34234 numMergedOcc 0
16 mol 195 unq 3 iso 0 dist 4.78641 9.33058 6.60567 15.7161 11.9954 7.87972 numMergedOcc 0
17 mol 207 unq 0 iso 0 dist 5.18312 5.18702 8.32218 13.3016 14.0642 8.78061 numMergedOcc 0
18 mol 218 unq 0 iso 0 dist 9.79816 8.17702 6.29511 14.0589 6.0516 8.04838 numMergedOcc 0
19 mol 264 unq 0 iso 0 dist 8.85887 5.95173 6.42588 10.3051 6.56539 6.02757 numMergedOcc 0
20 mol 264 unq 1 iso 0 dist 8.85887 5.95173 6.42588 12.6614 4.76241 8.67231 numMergedOcc 0
21 mol 264 unq 2 iso 0 dist 6.65233 6.79049 6.14323 12.6602 13.2035 7.14086 numMergedOcc 0
