0 mol 92 unq 0 iso 0 dist 9.68629 5.92795 9.99441 10.3334 8.11408 6.98037 11.104 12.8197 5.31547 6.61823 numMergedOcc 0
1 mol 130 unq 0 iso 0 dist 5.82945 9.25976 7.5573 7.39532 6.76477 6.5739 3.96103 6.93139 7.21225 8.33077 numMergedOcc 0
2 mol 178 unq 0 iso 0 dist 9.42866 13.0468 7.86352 14.9496 7.323 8.25282 17.3766 9.79683 6.42973 4.92088 numMergedOcc 0
3 mol 186 unq 0 iso 0 dist 9.18289 5.33968 5.67168 9.38115 5.40422 7.04815 11.7795 14.3269 13.6744 9.83476 numMergedOcc 0
4 mol 186 unq 1 iso 0 dist 9.18289 10.9974 5.86483 9.38115 5.40422 6.07389 11.7795 14.3269 15.0914 9.83476 numMergedOcc 0
5 mol 195 unq 0 iso 0 dist 8.60546 3.7157 8.22795 9.63146 10.9712 6.34234 5.90604 8.9507 5.41635 6.60567 numMergedOcc 0
6 mol 195 unq 1 iso 0 dist 8.60546 3.7157 8.22795 9.63146 10.9712 6.34234 8.97729 12.662 6.04871 7.62942 numMergedOcc 0
7 mol 195 unq 2 iso 0 dist 9.48766 6.61517 6.396 12.5586 8.68163 7.87972 17.3581 14.4992 11.9954 6.60567 numMergedOcc 0
8 mol 195 unq 3 iso 0 dist 9.48766 6.61517 6.396 12.5586 8.68163 7.87972 8.95444 11.8893 8.04534 7.62942 numMergedOcc 0
9 mol 225 unq 0 iso 0 dist 9.49163 12.7552 9.3502 14.5569 6.05548 7.8744 16.3786 12.2719 3.97158 8.87609 numMergedOcc 0
10 mol 225 unq 1 iso 0 dist 9.49163 12.7092 6.46405 14.5569 6.05548 4.98402 16.3786 12.2719 9.9875 8.87609 numMergedOcc 0
11 mol 225 unq 2 iso 0 dist 9.99149 14.0407 9.3502 14.7011 6.05548 7.8744 17.1729 12.2719 3.97158 8.87609 numMergedOcc 0
12 mol 225 unq 3 iso 0 dist 9.99149 11.662 6.46405 14.7011 6.05548 4.98402 17.1729 12.2719 9.9875 8.87609 numMergedOcc 0
13 mol 227 unq 0 iso 0 dist 8.79884 5.25298 6.09335 11.2801 11.2819 9.43618 9.04956 9.91384 5.0317 8.03442 numMergedOcc 0
14 mol 236 unq 0 iso 0 dist 9.94117 5.45156 8.93212 9.30828 8.32937 9.14068 9.01197 15.106 11.5307 8.50331 numMergedOcc 0
15 mol 238 unq 0 iso 0 dist 6.96382 3.68226 4.66186 9.81362 8.5378 6.53286 6.34091 8.63015 4.48415 5.52379 numMergedOcc 0
16 mol 264 unq 0 iso 0 dist 9.13546 3.63202 9.78237 8.28871 5.82131 7.14086 11.5671 9.19754 11.4167 6.04162 numMergedOcc 0
17 mol 264 unq 1 iso 0 dist 9.13546 3.63202 9.78237 8.28871 5.82131 7.14086 13.8765 8.29262 13.2035 6.14323 numMergedOcc 0
18 mol 264 unq 2 iso 0 dist 8.7365 3.63202 9.95798 8.28871 9.58444 7.14086 11.5671 13.8802 11.4167 6.04162 numMergedOcc 0
19 mol 264 unq 3 iso 0 dist 8.7365 3.63202 9.95798 8.28871 9.58444 7.14086 13.8765 13.4196 13.2035 6.14323 numMergedOcc 0
20 mol 264 unq 4 iso 0 dist 7.19658 13.3131 9.78237 7.94668 5.82131 7.14086 5.21164 9.19754 11.4167 6.04162 numMergedOcc 0
21 mol 264 unq 5 iso 0 dist 7.19658 13.3131 9.78237 7.94668 5.82131 7.14086 6.12009 8.29262 13.2035 6.14323 numMergedOcc 0
