TOSLAB-ZINC04478191 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 -0.1720 1.5170 -0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 0.0170 -0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0590 -0.7210 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0390 -2.1160 -0.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0860 -2.7770 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.0570 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -0.6610 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -4.2290 -0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1130 -4.9500 1.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1400 -6.2790 0.6410 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 -6.5000 -0.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -5.1280 -1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2960 -4.9440 -2.5170 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 -3.6940 -2.9330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -3.2370 -4.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6860 -4.0870 -5.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -3.5780 -6.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3250 -2.2050 -6.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 -1.3270 -5.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0120 -1.8610 -4.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 0.1610 -5.7330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 0.8880 -4.9900 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8700 1.8860 0.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8200 1.9350 0.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 1.8840 -1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7910 -0.2110 -1.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7590 -2.6690 -1.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -2.5680 1.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4900 -0.1020 1.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2150 -7.0350 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1240 -3.0420 -2.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7170 -5.1560 -4.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8370 -4.2460 -6.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8450 -1.8100 -7.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -1.1780 -3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -7.5560 -1.4320 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0150 -7.2600 -2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4830 0.5800 -6.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 29 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 36 2 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 38 2 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 22 -1 M END