B4YPJ2 -OEChem-04012113102D 41 43 0 0 0 0 0 0 0999 V2000 2.0000 5.5420 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 2.3059 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1602 2.8937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5421 1.7181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6788 0.2368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5267 2.3059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1710 -4.0420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -0.0420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9389 1.4969 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -4.0420 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2479 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6299 0.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9389 1.4969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -1.0420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 3.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -1.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5729 -1.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7688 3.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 4.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -2.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5729 -2.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4389 -3.0420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 3.8194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 4.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 4.7330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -4.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -5.5420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5579 0.0089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8143 0.7980 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8419 -1.2320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -1.2320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 2.4440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 4.0933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8419 -2.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0360 -2.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5644 3.7546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8345 5.4039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9020 -4.3520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6850 -5.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3050 -6.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 -5.5420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 9 1 0 0 0 0 2 15 1 0 0 0 0 5 12 2 0 0 0 0 6 13 2 0 0 0 0 7 26 2 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 8 14 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 10 22 1 0 0 0 0 10 26 1 0 0 0 0 10 38 1 0 0 0 0 11 13 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 30 1 0 0 0 0 17 21 2 0 0 0 0 17 31 1 0 0 0 0 18 23 1 0 0 0 0 18 32 1 0 0 0 0 19 24 2 0 0 0 0 19 33 1 0 0 0 0 20 22 2 0 0 0 0 20 34 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 23 25 2 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 37 1 0 0 0 0 26 27 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 M END $$$$