LD6B2X -OEChem-05032300042D 43 47 0 0 0 0 0 0 0999 V2000 10.8207 2.9394 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.0303 3.9172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8154 3.0422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7106 -2.5231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 -1.9299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4161 -0.5617 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1270 -3.3279 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.3207 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9238 1.9507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8489 3.1486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0160 1.5456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3481 2.2899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7053 0.5951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3696 2.0837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7268 0.3888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0590 1.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -2.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1270 -1.7184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 -3.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7106 -2.5231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -1.5232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4376 -0.7679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -2.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -3.5232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 -3.0231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -1.5232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -0.5286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1155 1.3611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5302 2.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0423 3.7377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2834 3.4029 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1194 0.1336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9556 2.5451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4523 1.0053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -0.9032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3196 -3.9172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0236 -0.3064 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 -4.1432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9118 -3.3332 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0206 -3.0601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9389 -0.1138 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -1.2516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 9 1 0 0 0 0 1 10 1 0 0 0 0 4 20 1 0 0 0 0 4 41 1 0 0 0 0 5 26 1 0 0 0 0 5 28 1 0 0 0 0 6 15 1 0 0 0 0 6 22 2 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 7 37 1 0 0 0 0 8 27 1 0 0 0 0 8 28 2 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 2 0 0 0 0 13 33 1 0 0 0 0 14 16 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 17 21 1 0 0 0 0 18 20 2 0 0 0 0 18 22 1 0 0 0 0 19 24 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 38 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 24 39 1 0 0 0 0 25 40 1 0 0 0 0 26 27 2 0 0 0 0 27 42 1 0 0 0 0 28 43 1 0 0 0 0 M END $$$$