B9EMP4 -OEChem-04012114023D 42 44 0 0 0 0 0 0 0999 V2000 4.1452 -2.7322 1.4801 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.9131 -1.4335 -1.9590 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2377 -2.8149 -2.2943 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9167 -0.4337 -3.0199 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2234 -0.9953 3.0646 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8573 -2.0259 1.8668 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9633 -0.9303 -0.6891 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7414 0.9191 -0.0008 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1305 2.0658 -1.1959 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0681 4.1378 -1.0521 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0950 2.8528 0.8336 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3454 -1.4269 -1.1902 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6984 -0.2598 -0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1762 -1.4208 0.0495 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4364 -0.2720 -1.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1232 -2.5756 -0.5567 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3756 -2.5746 0.0599 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6363 0.2765 0.0215 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5221 0.8676 -0.5829 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4361 -1.3881 0.6582 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2542 0.2328 1.3583 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7106 1.4911 -0.6529 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1661 -0.2106 0.6044 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9431 1.4162 2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3995 2.6744 0.0168 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0158 2.6371 1.3573 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1683 -1.0264 2.0867 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4705 2.9498 -0.4888 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0654 0.6173 -1.7127 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4734 -3.4830 -0.5219 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6961 -3.4938 0.5429 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3725 -1.6802 -0.1178 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0256 1.5438 -1.6909 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1488 -0.1292 1.0599 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 1.4229 3.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4605 3.6256 -0.5039 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7827 3.5597 1.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -1.8473 3.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2716 4.3530 -2.0221 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5491 4.8275 -0.5199 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 3.6254 1.3033 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 2.0365 1.3958 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 5 27 1 0 0 0 0 5 38 1 0 0 0 0 6 27 2 0 0 0 0 7 18 1 0 0 0 0 7 32 1 0 0 0 0 8 19 2 0 0 0 0 8 23 1 0 0 0 0 9 19 1 0 0 0 0 9 28 2 0 0 0 0 10 28 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 28 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 19 1 0 0 0 0 14 17 1 0 0 0 0 14 20 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 21 1 0 0 0 0 18 22 2 0 0 0 0 20 23 2 0 0 0 0 21 24 2 0 0 0 0 21 27 1 0 0 0 0 22 25 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 24 26 1 0 0 0 0 24 35 1 0 0 0 0 25 26 2 0 0 0 0 25 36 1 0 0 0 0 26 37 1 0 0 0 0 M END $$$$