B2WJM8 -OEChem-04012113522D 46 48 0 1 0 0 0 0 0999 V2000 9.8622 -1.0858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -1.0858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7282 0.4142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.4142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.0858 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0576 -1.9488 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6418 0.0074 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3109 0.7506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8109 1.6166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8327 1.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.9142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 -0.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8622 -0.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 0.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3981 -0.0858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2641 0.4142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8497 -0.9707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.9488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -0.1205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.4350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1599 -0.3827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7257 0.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8125 1.1150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3773 1.8688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6193 2.2063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7679 2.0253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2127 1.4087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1426 1.3065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7441 1.9968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 2.3891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 2.3891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 -0.5608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 -0.5608 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3947 0.8891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5976 0.8891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6626 0.8891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8656 0.8891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1301 -0.7058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 2.5688 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -0.7404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.7471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.0813 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 18 2 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 3 14 1 0 0 0 0 4 11 1 0 0 0 0 4 13 1 0 0 0 0 4 18 1 0 0 0 0 5 17 1 0 0 0 0 5 19 1 0 0 0 0 5 42 1 0 0 0 0 6 20 3 0 0 0 0 7 8 1 0 0 0 0 7 20 1 1 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 15 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 21 2 0 0 0 0 16 22 2 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 21 23 1 0 0 0 0 21 43 1 0 0 0 0 22 24 1 0 0 0 0 22 44 1 0 0 0 0 23 24 2 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 M END $$$$