MOLFILE.cdx ChemDraw11091114462D 30 34 0 0 0 0 0 0 0 0999 V2000 -0.0834 1.9611 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0834 1.1371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6302 0.7251 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3439 1.1371 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3439 1.9611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2198 0.7219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2198 -0.1022 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5062 -0.5142 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7926 0.7219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7915 -0.1022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0813 -0.5110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6324 -0.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9828 2.6080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 2.3997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3591 2.9860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9983 1.6051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3746 1.9831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7955 1.3968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8608 1.3628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6238 2.2389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1376 2.6484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3746 1.7724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2605 2.8786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7344 1.1265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5065 -1.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2217 -1.7495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5122 -2.9860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7966 -2.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2239 -2.5699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7927 -1.7488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 2 0 1 5 1 0 6 7 2 0 7 8 1 0 8 10 1 0 6 9 1 0 9 10 2 0 9 2 1 0 10 11 1 0 11 12 2 0 12 3 1 0 5 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 18 1 0 17 18 1 0 6 19 1 0 19 20 2 0 21 22 1 0 19 24 1 0 20 23 1 0 23 21 2 0 22 24 2 0 8 25 1 0 25 26 2 0 27 28 1 0 25 30 1 0 26 29 1 0 29 27 2 0 28 30 2 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 6 13 14 15 16 17 18 M SBL 1 1 15 M SMT 1 CH2COOEt M SBV 1 15 -0.6389 -0.6469 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 6 19 20 21 22 23 24 M SBL 2 1 21 M SMT 2 ^Ph M SBV 2 21 0.6410 -0.6410 M STY 1 3 SUP M SLB 1 3 3 M SAL 3 6 25 26 27 28 29 30 M SBL 3 1 28 M SMT 3 Ph M SBV 3 28 0.0003 0.8240 M END