B5RSD7 -OEChem-04042104353D 39 41 0 0 0 0 0 0 0999 V2000 7.6103 -2.0617 0.2981 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.5425 0.9329 0.3678 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 -0.3440 -1.2037 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7025 -0.5291 -0.3011 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3620 -1.2485 2.0714 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6442 1.7030 0.3284 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7216 -0.2347 -0.6420 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0719 1.4238 1.0708 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4590 -0.7015 -0.0143 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9521 -0.7101 -0.0815 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7787 -1.0099 1.0997 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3332 -0.5856 -0.2051 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7012 -0.9719 1.0773 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 -0.3036 -1.2376 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7234 0.6394 -0.1304 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2439 0.6887 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2895 0.6815 0.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3761 -0.5489 0.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3946 1.7847 -0.5044 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0591 -0.4003 -0.7031 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7643 -0.5944 -0.0076 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7827 1.7393 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4676 0.5497 -0.3846 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9548 0.2992 0.0797 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5669 -1.4051 -1.6822 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3988 1.2072 0.9572 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2735 -0.9810 -1.0931 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3666 -1.4530 0.6095 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2692 -1.2876 2.0252 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8834 -0.0124 -2.2171 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8402 -1.4424 0.4295 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8724 2.7154 -0.7043 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3304 2.6298 -0.9274 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5493 0.5291 -0.4892 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0255 0.1531 0.0173 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1232 -2.1934 -1.1651 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7414 -1.8759 -2.2262 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2236 -0.9250 -2.4147 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0235 1.8038 1.6133 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 2 10 1 0 0 0 0 2 17 1 0 0 0 0 3 9 1 0 0 0 0 3 14 1 0 0 0 0 4 12 1 0 0 0 0 4 16 1 0 0 0 0 5 13 2 0 0 0 0 6 16 2 0 0 0 0 7 17 1 0 0 0 0 7 20 2 0 0 0 0 8 17 2 0 0 0 0 8 26 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 13 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 18 2 0 0 0 0 15 19 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 22 2 0 0 0 0 19 32 1 0 0 0 0 20 24 1 0 0 0 0 20 25 1 0 0 0 0 21 23 2 0 0 0 0 22 23 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 24 26 2 0 0 0 0 24 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 25 38 1 0 0 0 0 26 39 1 0 0 0 0 M END $$$$