IBS-ZINC00500474 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 42 0 0 1 0 0 0 0 0999 V2000 2.2180 -1.8470 -1.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -1.7200 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 -2.5170 0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 -2.4010 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -1.4870 0.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -0.6860 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.7970 -1.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 0.0170 -2.4250 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -0.5410 -3.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4220 -1.7420 -3.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 0.3270 -4.8740 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8410 1.2440 -4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 0.6690 -5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6230 1.9390 -5.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9250 2.2530 -5.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7360 1.2970 -5.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2450 0.0270 -6.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -0.2850 -5.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 1.6330 -6.3010 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5630 2.7520 -6.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8450 0.7910 -6.8140 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9230 -0.3940 -5.9800 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 0.2900 -6.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 1.4980 -6.9150 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1780 0.3090 -0.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0710 -2.6750 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3530 -0.9230 -2.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1020 -2.0350 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6690 -3.2320 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -3.0260 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0690 -1.3990 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 0.9820 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9890 2.6860 -4.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3080 3.2450 -5.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -0.7200 -6.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -1.2760 -6.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -1.3640 -5.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9150 -0.2370 -7.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9060 1.2860 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 0.3780 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1180 -0.0170 -0.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M END