BGC3X2 -OEChem-04022106213D 41 44 0 0 0 0 0 0 0999 V2000 3.0425 -0.6476 -2.9204 I 0 0 0 0 0 0 0 0 0 0 0 0 -8.0345 0.9702 -0.0840 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.5961 1.2410 0.0403 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -2.5462 0.1048 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5724 2.7849 0.0572 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3892 -2.0828 0.1363 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4900 4.1511 0.0738 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3496 2.0977 0.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8280 0.3510 0.1042 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2310 0.4871 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0321 -0.7937 0.1066 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0851 1.5264 0.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3665 -0.4529 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0570 -0.7031 0.1659 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7805 1.7651 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9209 2.8486 0.0831 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5195 -1.2968 0.0664 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5077 -1.3394 -0.9922 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4022 -1.2138 1.4183 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9058 -0.7258 0.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3013 -2.4828 -0.8977 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1956 -2.3573 1.5125 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6451 -2.9917 0.3546 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4842 -0.4993 -1.1952 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5332 -0.4575 1.2199 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 1.9494 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7741 0.0303 -1.2304 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8231 0.0721 1.1848 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4437 0.3159 -0.0406 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0619 -0.7348 2.3337 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3548 -2.3805 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2667 -2.8591 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6644 -2.9961 -1.7846 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4632 -2.7538 2.4876 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2628 -3.8820 0.4285 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3783 4.2892 -0.3921 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8340 4.9232 0.0588 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9664 -0.7218 -2.1229 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0533 -0.6473 2.1749 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2452 0.2152 -2.1925 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3325 0.2897 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 29 1 0 0 0 0 3 12 1 0 0 0 0 3 13 1 0 0 0 0 4 17 2 0 0 0 0 5 12 1 0 0 0 0 5 16 2 0 0 0 0 6 11 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 16 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 26 3 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 12 2 0 0 0 0 10 14 1 0 0 0 0 10 15 2 0 0 0 0 11 13 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 19 2 0 0 0 0 15 16 1 0 0 0 0 15 26 1 0 0 0 0 17 20 1 0 0 0 0 18 21 2 0 0 0 0 19 22 1 0 0 0 0 19 30 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 23 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 35 1 0 0 0 0 24 27 1 0 0 0 0 24 38 1 0 0 0 0 25 28 2 0 0 0 0 25 39 1 0 0 0 0 27 29 2 0 0 0 0 27 40 1 0 0 0 0 28 29 1 0 0 0 0 28 41 1 0 0 0 0 M END $$$$