0 mol 8 unq 0 iso 0 dist 8.33604 8.53529 11.4716 12.4076 17.5554 7.03958 16.4393 18.2006 8.07902 7.92414 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.33604 8.53529 11.4716 12.4076 17.5554 7.03958 7.3915 11.705 5.65816 6.82379 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 9.87449 8.64915 10.9409 10.5747 17.2884 7.32257 12.6235 17.501 8.88528 7.05346 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 9.87449 8.64915 10.9409 5.06358 12.9221 6.55811 7.032 6.93413 4.58685 7.9944 numMergedOcc 0
4 mol 9 unq 2 iso 0 dist 9.87449 8.17347 8.50857 5.06358 12.9221 7.36018 7.032 6.93413 5.83039 7.9944 numMergedOcc 0
5 mol 19 unq 0 iso 0 dist 6.20943 8.40416 11.4087 7.67038 7.82528 7.75618 10.1882 6.34272 13.9675 6.92532 numMergedOcc 0
6 mol 24 unq 0 iso 0 dist 9.75144 7.29868 13.719 10.0952 12.4274 8.60554 10.7114 11.3767 6.99746 6.72502 numMergedOcc 0
7 mol 25 unq 0 iso 0 dist 7.685 8.6653 12.9735 10.6808 16.7035 7.92503 5.81959 9.96732 6.61233 6.90155 numMergedOcc 0
8 mol 26 unq 0 iso 0 dist 8.82012 6.46104 4.98603 7.96502 10.9838 7.36856 10.4035 4.80984 5.30297 8.6385 numMergedOcc 0
9 mol 195 unq 0 iso 0 dist 8.36117 9.26504 4.4994 10.7531 9.36654 7.36683 7.62942 9.08602 6.0634 6.60567 numMergedOcc 0
10 mol 195 unq 1 iso 0 dist 6.77578 9.26504 5.99784 10.7531 11.955 7.36683 7.62942 8.18628 6.0634 6.60567 numMergedOcc 0
11 mol 235 unq 0 iso 0 dist 5.65339 6.21292 7.96337 8.31875 10.4621 6.36341 11.0084 14.8031 7.85398 6.39158 numMergedOcc 0
12 mol 235 unq 1 iso 0 dist 9.43058 9.21736 17.5445 10.5547 19.8728 6.36341 11.2916 20.3334 7.85398 6.39158 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 9.29858 9.24557 10.3809 10.0191 12.5477 7.57812 7.32982 6.48619 4.77308 6.66971 numMergedOcc 0
14 mol 238 unq 1 iso 0 dist 9.90142 7.57812 10.3147 10.0191 10.7386 9.24557 6.66971 5.8333 4.77308 7.32982 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 6.35287 8.00673 7.83538 8.29447 12.1774 6.62841 12.4198 17.9429 13.537 7.67245 numMergedOcc 0
