B9FVW3 -OEChem-04022116023D 33 34 0 0 0 0 0 0 0999 V2000 -3.4577 -1.8145 0.5409 S 0 0 0 0 0 0 0 0 0 0 0 0 1.5147 -0.5670 1.0729 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8859 0.0727 -1.0738 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6522 1.4061 0.1249 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7563 0.1623 -0.4877 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3395 -0.7707 0.4461 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2142 -2.1187 -1.2040 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7047 1.1220 -0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 1.2809 0.6514 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5659 -0.3867 0.1681 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4334 0.5650 -0.3765 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1972 -0.1275 0.3447 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1388 0.4304 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6551 0.5759 0.6504 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5479 2.0844 -0.5847 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9096 1.8196 -0.7576 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8817 -1.0644 -0.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1557 -1.8151 -0.0047 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2028 -0.8545 -0.6426 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2344 1.5757 -0.3804 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9127 2.1950 1.2493 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0682 1.0098 1.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9187 0.1244 2.2393 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5965 -0.9161 0.7715 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9409 2.3342 -0.1777 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1613 3.0560 -0.8834 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5596 2.5786 -1.1836 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8162 -1.6002 0.7093 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0918 -2.7256 -0.6094 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4217 -2.0929 1.0203 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9716 -1.2054 -0.4066 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7969 -2.3317 -2.0067 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6432 -2.8710 -0.8341 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 17 1 0 0 0 0 2 14 2 0 0 0 0 3 19 2 0 0 0 0 4 8 1 0 0 0 0 4 14 1 0 0 0 0 4 25 1 0 0 0 0 5 11 1 0 0 0 0 5 17 2 0 0 0 0 6 13 1 0 0 0 0 6 19 1 0 0 0 0 6 28 1 0 0 0 0 7 19 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 12 2 0 0 0 0 8 15 1 0 0 0 0 9 13 1 0 0 0 0 9 14 1 0 0 0 0 9 20 1 0 0 0 0 9 21 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 16 1 0 0 0 0 12 24 1 0 0 0 0 13 22 1 0 0 0 0 13 23 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 18 31 1 0 0 0 0 M END $$$$