B9F3GY -OEChem-04042104203D 57 59 0 0 0 0 0 0 0999 V2000 -5.4568 -2.1475 0.2529 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5517 1.7314 0.9825 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8513 3.2803 1.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5613 -2.4470 -1.1666 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1354 -3.2049 1.1980 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0868 -0.7659 -2.7160 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.6803 0.5727 -2.0173 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0781 1.9404 0.8204 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4426 0.9330 -1.0103 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6142 -0.0582 -1.8259 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2226 2.0039 -0.9517 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6656 3.2711 -0.2959 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1792 0.8847 -1.0213 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9325 2.9785 1.0116 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4392 0.6697 0.3001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4594 1.5477 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4157 2.2159 1.1129 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6947 0.4423 -0.4402 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4046 1.1542 0.8908 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2919 0.7360 -2.4463 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0418 1.0408 -0.3448 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5996 -0.9997 -0.0331 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7073 0.2586 1.9164 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9814 0.0316 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -0.8641 0.4706 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6469 -0.7506 1.7064 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1854 -1.3353 1.2559 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9253 -2.0041 -0.9446 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0968 -2.6753 1.6335 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8365 -3.3440 -0.5671 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9996 -1.4168 0.7471 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4225 -3.6795 0.7219 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4845 2.3014 -1.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 3.7383 -0.9928 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4619 4.0032 -0.1158 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6266 -0.0672 -1.3263 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4412 1.1507 -1.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4627 3.9028 1.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5963 2.6498 1.8153 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1178 0.2620 1.0585 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3546 -0.0660 0.1549 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9397 1.0491 0.4406 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5126 0.6053 -1.1529 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4144 1.7035 -2.9427 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3122 0.3231 -2.6906 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0513 0.0540 -2.8368 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8016 1.7416 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2176 0.3393 2.8835 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8700 -1.4290 2.5249 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9299 -0.5640 1.9773 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2587 -1.7606 -1.9493 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7805 -2.1730 0.6418 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9258 -1.1035 1.7902 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2195 -0.5651 0.1018 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7746 -2.9365 2.6372 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0920 -4.1261 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3540 -4.7227 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 25 1 0 0 0 0 1 31 1 0 0 0 0 2 16 2 0 0 0 0 3 17 2 0 0 0 0 6 10 1 0 0 0 0 7 10 2 0 0 0 0 8 14 1 0 0 0 0 8 15 1 0 0 0 0 8 17 1 0 0 0 0 9 16 1 0 0 0 0 9 18 1 0 0 0 0 9 20 1 0 0 0 0 10 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 11 33 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 15 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 17 19 1 0 0 0 0 18 22 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 21 2 0 0 0 0 19 23 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 24 1 0 0 0 0 21 47 1 0 0 0 0 22 27 2 0 0 0 0 22 28 1 0 0 0 0 23 26 2 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 27 29 1 0 0 0 0 27 50 1 0 0 0 0 28 30 2 0 0 0 0 28 51 1 0 0 0 0 29 32 2 0 0 0 0 29 55 1 0 0 0 0 30 32 1 0 0 0 0 30 56 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 57 1 0 0 0 0 M CHG 2 6 -1 10 1 M END $$$$