DR5502 -OEChem-08132116302D 37 39 0 0 0 0 0 0 0999 V2000 4.2690 -2.5591 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 9.6846 0.1200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 0.2456 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6811 2.3529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -1.3638 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.4409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.0591 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.4409 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3919 1.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3704 1.4024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0382 0.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0168 0.8643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3274 1.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6648 -0.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7276 -0.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6596 2.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3059 2.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.5591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.0591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6631 0.3262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3713 1.8158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7781 1.2835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2848 -0.5591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1383 -0.0998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5350 -0.8818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3169 -0.4851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8522 3.1484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4338 1.4144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9126 2.1489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1781 2.6277 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7910 -0.2805 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2698 0.4541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5352 0.9329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1309 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.0609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 13 1 0 0 0 0 2 22 1 0 0 0 0 3 9 1 0 0 0 0 3 12 1 0 0 0 0 3 16 1 0 0 0 0 4 10 2 0 0 0 0 4 18 1 0 0 0 0 5 15 1 0 0 0 0 5 16 2 0 0 0 0 6 12 1 0 0 0 0 6 21 2 0 0 0 0 7 20 2 0 0 0 0 7 21 1 0 0 0 0 8 21 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 11 13 2 0 0 0 0 11 17 1 0 0 0 0 12 15 2 0 0 0 0 13 14 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 20 1 0 0 0 0 16 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 17 28 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 M END $$$$