BX4HS5 -OEChem-04012112372D 57 61 0 0 0 0 0 0 0999 V2000 2.0000 -3.3298 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.7794 -3.2334 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.3421 -1.2467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2458 -4.3595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8421 3.0834 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3421 0.4854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2585 -1.1854 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1110 -3.8580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8421 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8421 1.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3421 2.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3421 2.2174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8421 3.0834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3421 3.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8421 -0.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8421 -0.3807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8421 4.8155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3123 -0.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2585 0.4241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3123 0.1193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5692 -2.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4463 -1.3806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4463 0.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9014 -2.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5803 -0.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5803 0.1193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9066 -2.7774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5015 -3.6916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5237 -3.9012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1186 -4.8155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1238 -4.7127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9142 -3.7349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5321 0.8145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2595 1.1394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9498 0.7408 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8171 1.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8171 2.6160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8672 2.6160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8672 1.8189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4248 3.2955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7345 3.6940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9621 0.4854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8672 4.3480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8672 3.5510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3791 4.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1521 5.3524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3052 5.1255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4511 1.0134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9518 -2.6238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1161 -1.8439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4463 -2.0006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4463 1.2394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0433 -1.1906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0433 0.4293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5957 -2.2410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4295 -5.3519 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7098 -5.1742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 2 29 1 0 0 0 0 2 32 1 0 0 0 0 3 15 2 0 0 0 0 4 8 1 0 0 0 0 4 28 1 0 0 0 0 5 12 1 0 0 0 0 5 13 1 0 0 0 0 5 14 1 0 0 0 0 6 9 1 0 0 0 0 6 15 1 0 0 0 0 6 42 1 0 0 0 0 7 16 1 0 0 0 0 7 18 1 0 0 0 0 7 21 1 0 0 0 0 8 24 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 33 1 0 0 0 0 10 12 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 17 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 19 2 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 20 1 0 0 0 0 18 22 2 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 23 2 0 0 0 0 21 24 1 0 0 0 0 21 49 1 0 0 0 0 21 50 1 0 0 0 0 22 25 1 0 0 0 0 22 51 1 0 0 0 0 23 26 1 0 0 0 0 23 52 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 30 56 1 0 0 0 0 31 32 2 0 0 0 0 31 57 1 0 0 0 0 M END $$$$