B3QZ4H -OEChem-04022110423D 42 44 0 1 0 0 0 0 0999 V2000 2.7365 -1.2172 -1.5732 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3539 1.8678 -0.4890 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4178 -0.8747 1.0624 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3520 -1.6970 0.2714 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9876 -1.7882 0.0092 C 0 0 2 0 0 0 0 0 0 0 0 0 3.2821 0.1179 0.6176 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5718 0.1111 -0.7516 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4757 -3.1997 0.3302 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4979 -1.7264 -0.1119 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2232 -0.6351 0.1877 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8423 1.0953 1.4316 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4127 1.0537 -1.3254 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6891 -0.5326 0.0921 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3077 0.6807 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6919 2.0511 0.8677 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9756 2.0298 -0.5034 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6959 0.7003 -0.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4129 -0.4776 -0.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5249 1.9379 -0.3533 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7003 -1.6390 0.1907 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8999 -0.5097 -0.1318 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7324 2.6519 0.6401 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 -0.9952 2.0367 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -3.2355 0.4449 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1917 -3.9193 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0482 -3.5556 1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0063 -2.6217 -0.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2779 0.2703 0.5159 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6279 1.1239 2.4959 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6338 1.0419 -2.3878 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.8176 1.4974 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6373 2.7793 -0.9285 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 2.2970 0.6084 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6852 1.7796 -1.0392 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1173 2.7434 -0.7986 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2011 -2.5905 0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3340 -0.1546 0.8078 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2694 0.1108 -0.9549 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2681 -1.5256 -0.3129 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2215 3.5598 0.2764 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8541 2.9410 1.2259 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4384 2.1066 1.2734 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 7 1 0 0 0 0 2 17 1 0 0 0 0 2 22 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 3 23 1 0 0 0 0 4 13 2 0 0 0 0 4 20 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 12 2 0 0 0 0 8 24 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 10 2 0 0 0 0 9 27 1 0 0 0 0 10 13 1 0 0 0 0 10 28 1 0 0 0 0 11 15 1 0 0 0 0 11 29 1 0 0 0 0 12 16 1 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 14 17 2 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 36 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$