BQ5RA3 -OEChem-04022104393D 45 48 0 1 0 0 0 0 0999 V2000 -2.6557 1.7135 0.6026 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6204 -0.2926 -1.1432 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8528 1.6061 1.6490 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4363 0.3230 -0.1486 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3035 -3.0761 -1.2615 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0206 -0.4148 2.4576 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.5442 -1.8146 1.7156 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1975 1.2756 -0.0724 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4487 2.6166 0.2763 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0683 -0.8752 -0.1143 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3355 -0.6229 0.2234 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1235 0.8616 -1.5221 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3593 -2.7292 -0.0895 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4056 -0.7928 -0.7796 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7351 -0.8662 1.5206 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3213 0.4787 0.9834 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5834 0.8667 -0.2889 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3903 -0.4492 0.4411 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6456 -1.1929 -0.6633 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9737 -2.4673 -0.1717 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1019 0.4611 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7524 2.5606 0.1007 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0292 1.3113 0.2152 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2267 0.7235 0.3278 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -1.3282 0.0119 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8552 0.6958 -0.2176 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -0.3043 0.2404 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0777 -0.0689 -1.8268 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5599 1.8009 -2.4656 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6646 -0.0603 1.6762 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0739 1.6925 -0.8195 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8375 -1.0909 1.2054 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2897 -1.4187 -1.5207 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2400 -2.2775 0.6167 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7154 -3.1749 0.2106 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4741 2.0468 1.0447 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0795 -0.3009 -0.5264 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4219 3.4099 0.0904 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6435 -2.4418 -1.5901 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4514 -3.3115 -0.2474 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2831 -3.1300 -0.0042 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4949 -0.1761 -2.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4892 1.6027 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0408 1.6720 -3.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7415 2.8151 -2.1012 H 0 0 0 0 0 0 0 0 0 0 0 0 1 24 1 0 0 0 0 1 26 1 0 0 0 0 2 17 1 0 0 0 0 2 19 1 0 0 0 0 3 16 1 0 0 0 0 3 36 1 0 0 0 0 4 18 1 0 0 0 0 4 37 1 0 0 0 0 5 20 1 0 0 0 0 5 39 1 0 0 0 0 6 15 1 0 0 0 0 7 15 2 0 0 0 0 8 17 1 0 0 0 0 8 21 1 0 0 0 0 8 22 1 0 0 0 0 9 22 2 0 0 0 0 9 23 1 0 0 0 0 10 21 1 0 0 0 0 10 25 2 0 0 0 0 11 24 2 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 25 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 27 1 0 0 0 0 14 28 2 0 0 0 0 15 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 26 27 2 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 M CHG 2 6 -1 15 1 M END $$$$