BR1U7W -OEChem-04022114343D 44 47 0 1 0 0 0 0 0999 V2000 0.8937 -0.8185 -1.8599 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.9099 3.6752 -0.3951 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5371 -1.7937 -0.0822 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6392 0.5366 -0.6275 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1973 0.1730 0.6108 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9683 1.1724 -0.2592 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4954 -0.5311 0.2297 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7859 -2.2700 -0.8214 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7683 0.2522 0.2105 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3667 -2.5777 -0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2435 2.4851 -0.6424 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9136 0.4438 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4091 2.3410 0.4191 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4637 3.0696 -0.3031 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 1.0282 0.8021 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8873 -3.1380 -0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7446 1.6148 -0.0869 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3840 -3.7550 0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9801 -0.3798 0.4899 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8555 -4.2974 -0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7205 -4.6059 0.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9327 2.3456 -0.1049 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7144 2.9653 0.7805 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1681 0.3509 0.4722 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1445 1.7136 0.1745 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0676 1.2742 -1.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3551 -0.4624 1.3142 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4189 1.0792 1.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5173 3.0664 -1.2043 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7205 -0.5761 0.7809 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6657 4.0937 -0.6056 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8611 0.4517 1.3679 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -2.9212 -1.3696 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8163 2.1275 -0.3165 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0219 -1.4385 0.7315 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2679 -4.0166 1.2688 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7150 -4.9609 0.0004 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6914 -5.5112 1.3222 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0215 3.7018 0.0302 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5097 2.2142 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6357 3.4651 1.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1115 -0.1405 0.6915 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0733 2.2774 0.1624 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9911 3.9472 -0.5615 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 2 22 1 0 0 0 0 2 44 1 0 0 0 0 3 7 2 0 0 0 0 3 10 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 26 1 0 0 0 0 5 7 1 0 0 0 0 5 27 1 0 0 0 0 5 28 1 0 0 0 0 6 11 2 0 0 0 0 6 12 1 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 2 0 0 0 0 9 17 2 0 0 0 0 9 19 1 0 0 0 0 10 18 2 0 0 0 0 11 14 1 0 0 0 0 11 29 1 0 0 0 0 12 15 2 0 0 0 0 12 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 14 31 1 0 0 0 0 15 32 1 0 0 0 0 16 20 1 0 0 0 0 16 33 1 0 0 0 0 17 22 1 0 0 0 0 17 34 1 0 0 0 0 18 21 1 0 0 0 0 18 36 1 0 0 0 0 19 24 2 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 22 25 2 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$