LD3M0I -OEChem-05022322333D 27 28 0 0 0 0 0 0 0999 V2000 2.4138 1.5420 -0.1546 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.7227 -0.0999 -0.2966 S 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 1.8957 0.9207 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6542 1.8933 -1.5382 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5138 0.3378 -1.4311 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4914 -1.5123 -0.0615 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2156 0.7192 -0.3511 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3996 0.5871 1.1232 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0479 0.7843 0.4833 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8282 -0.4424 0.2744 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1488 -0.1771 -0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7702 1.9015 0.2873 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3888 0.7423 0.8699 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -1.7651 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0936 -1.1501 -0.3366 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3556 -2.7812 0.1329 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6796 -2.4751 -0.2244 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 2.9137 0.3841 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6509 1.6397 1.4434 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5958 -0.1179 1.5137 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5919 -2.0325 0.6551 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1121 -0.9034 -0.6117 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2197 1.6215 -0.8462 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0504 -3.8212 0.2148 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3840 -3.2802 -0.4145 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6851 1.5730 1.0819 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9985 0.3071 2.0265 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 7 1 0 0 0 0 2 8 1 0 0 0 0 7 13 1 0 0 0 0 7 23 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 14 2 0 0 0 0 11 15 2 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 13 20 1 0 0 0 0 14 16 1 0 0 0 0 14 21 1 0 0 0 0 15 17 1 0 0 0 0 15 22 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 M END $$$$