B2QIJ6 -OEChem-04022117503D 53 56 0 1 0 0 0 0 0999 V2000 2.3359 1.4641 -2.6910 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.8422 -1.8710 2.2704 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9465 0.0907 0.0492 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1074 1.9364 0.3374 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5314 -0.9914 -0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0371 0.6587 0.0384 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3016 -2.2035 -0.0939 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0353 -2.9030 -0.1693 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2350 -0.1768 -0.6023 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9953 0.9891 1.2067 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9761 1.1323 -0.8839 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7774 2.2605 0.8673 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9563 -0.8954 -0.0229 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6084 -0.5507 -0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8059 -1.6705 -0.1387 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3043 -1.5908 -0.0967 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3189 0.3593 0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8641 3.1586 0.0679 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0106 -2.6041 1.0621 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9621 -2.4374 -1.4548 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2992 -3.1125 -0.1617 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3962 1.3229 0.0422 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7289 -4.5404 -0.2384 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9270 1.8823 -1.1201 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9046 1.6903 1.2881 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9661 2.8090 -1.0366 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9439 2.6170 1.3716 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4747 3.1764 0.2093 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8438 -0.8266 0.0395 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0831 -0.6975 -1.5561 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4711 0.4668 2.0468 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9927 1.2807 1.5376 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9687 0.8858 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4439 1.6949 -1.6629 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2069 2.8597 0.1448 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8739 2.8574 1.7824 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5942 -0.9118 -0.1004 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8697 2.9159 -0.2933 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 3.7951 -0.6777 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9932 3.7409 0.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3035 -3.4392 1.0655 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0249 -3.0176 1.0508 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9786 -2.8362 -1.5433 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -1.7835 -2.3153 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2716 -3.2833 -1.5297 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9487 -5.1619 -0.6892 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6335 -4.6383 -0.8468 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9385 -4.9169 0.7671 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 1.2651 2.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9913 -2.4921 3.0035 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3915 3.2546 -1.9323 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3399 2.9031 2.3416 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2839 3.8978 0.2745 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 2 19 1 0 0 0 0 2 50 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 13 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 18 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 5 17 1 0 0 0 0 6 14 1 0 0 0 0 6 17 2 0 0 0 0 7 13 2 0 0 0 0 7 21 1 0 0 0 0 8 16 1 0 0 0 0 8 21 2 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 14 16 2 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 15 37 1 0 0 0 0 17 22 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 2 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 26 2 0 0 0 0 25 27 1 0 0 0 0 25 49 1 0 0 0 0 26 28 1 0 0 0 0 26 51 1 0 0 0 0 27 28 2 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 M END $$$$