0 mol 11 unq 0 iso 0 dist 6.50001 4.46394 6.859 5.95165 4.10106 5.96346 5.51164 9.33059 4.54105 6.40513 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.54508 10.5851 8.49709 15.9016 13.0212 9.01567 21.4999 19.4859 15.2995 6.85331 numMergedOcc 0
2 mol 25 unq 0 iso 0 dist 5.77745 4.32173 5.20109 8.6396 6.47509 7.45383 16.5953 14.1443 14.4951 8.23292 numMergedOcc 0
3 mol 41 unq 0 iso 0 dist 4.47883 9.73623 6.21128 17.2956 13.4019 8.51663 16.2938 11.959 8.68242 4.68793 numMergedOcc 0
4 mol 41 unq 1 iso 0 dist 6.07514 7.10946 6.21128 13.3754 13.4019 8.51663 13.911 11.959 8.68242 4.68793 numMergedOcc 0
5 mol 155 unq 0 iso 0 dist 7.25009 5.45915 9.24038 4.44292 7.10286 6.53347 7.64573 5.55218 12.1461 8.66709 numMergedOcc 0
6 mol 171 unq 0 iso 0 dist 6.51523 4.98945 7.47964 6.07091 7.5383 9.61462 5.24208 9.67711 6.4423 6.01711 numMergedOcc 0
7 mol 186 unq 0 iso 0 dist 6.26168 5.18732 9.99396 9.44405 10.8286 8.73217 9.26214 14.1366 6.0361 7.45401 numMergedOcc 0
8 mol 188 unq 0 iso 0 dist 7.6482 5.15888 8.66624 11.4309 9.71636 7.14503 11.4221 14.5916 6.58929 7.95028 numMergedOcc 0
9 mol 212 unq 0 iso 0 dist 5.03184 6.48939 9.10288 5.87223 3.9436 8.69988 10.1355 10.7857 7.05237 7.87125 numMergedOcc 0
10 mol 212 unq 1 iso 0 dist 5.03184 5.81626 6.19798 5.87223 3.9436 8.55903 10.1355 10.7857 11.3998 7.87125 numMergedOcc 0
11 mol 274 unq 0 iso 0 dist 4.97796 6.70266 9.65868 10.0379 14.7507 7.46394 17.9835 22.2821 13.6675 9.81087 numMergedOcc 0
12 mol 274 unq 1 iso 0 dist 4.97796 6.70266 9.65868 12.5213 12.5615 8.91672 13.9843 16.4504 7.28382 9.79674 numMergedOcc 0
13 mol 274 unq 2 iso 0 dist 7.15079 9.95931 7.77765 9.87411 5.22914 7.46394 16.839 9.71389 13.6675 9.81087 numMergedOcc 0
14 mol 274 unq 3 iso 0 dist 7.15079 9.95931 7.77765 17.4438 16.5034 8.91672 16.6461 11.8611 7.28382 9.79674 numMergedOcc 0
