BSN0I8 -OEChem-04012116422D 51 54 0 0 0 0 0 0 0999 V2000 2.1051 5.3473 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 6.4783 -4.1520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7674 -1.3858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -1.3473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -5.3473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1211 -0.8477 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0829 5.1377 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.7199 3.4441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6532 2.8153 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -2.3126 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3975 3.4831 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2627 2.9816 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -2.8473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -3.8473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4783 -2.5425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0619 -3.3473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -2.3473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -3.8473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -2.8473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -4.3473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7889 -1.5920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0619 -3.3473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -4.3819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7209 1.2595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6754 3.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0531 2.0038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0781 -0.4353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0584 1.9010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4103 0.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3681 3.9765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6994 1.4658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0566 -0.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3673 0.7215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3903 4.1861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0619 -3.9673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6819 -3.3473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0619 -2.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -5.0019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0613 2.9397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6527 2.4053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7475 1.3646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8036 0.1812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -4.1802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9822 4.0617 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3908 4.5961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -2.5144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8920 2.0551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4707 -0.6905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9740 0.8493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2 14 1 0 0 0 0 2 16 1 0 0 0 0 3 21 1 0 0 0 0 3 27 1 0 0 0 0 4 17 2 0 0 0 0 5 20 2 0 0 0 0 6 21 2 0 0 0 0 7 36 1 0 0 0 0 8 36 2 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 28 1 0 0 0 0 10 19 1 0 0 0 0 10 32 2 0 0 0 0 11 12 2 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 17 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 17 19 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 22 39 1 0 0 0 0 23 30 2 0 0 0 0 23 40 1 0 0 0 0 24 26 1 0 0 0 0 24 29 2 0 0 0 0 24 33 1 0 0 0 0 25 31 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 28 2 0 0 0 0 27 29 1 0 0 0 0 27 34 2 0 0 0 0 28 43 1 0 0 0 0 29 44 1 0 0 0 0 30 32 1 0 0 0 0 30 45 1 0 0 0 0 31 36 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 33 35 2 0 0 0 0 33 49 1 0 0 0 0 34 35 1 0 0 0 0 34 50 1 0 0 0 0 35 51 1 0 0 0 0 M CHG 2 1 1 7 -1 M END $$$$