CHEMBRIDGE-ZINC04197009 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.2500 1.7080 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 0.3400 -2.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 -0.5860 -1.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9750 -0.1270 -1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.2370 -0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3950 2.1570 -1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6410 3.6130 -1.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 4.3900 -1.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 4.0150 -1.4800 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3290 5.4200 -1.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 5.9720 -0.0120 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4440 5.6360 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 7.4890 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 7.7140 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0070 6.5680 1.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4860 5.4920 0.7090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6350 -1.9760 -1.7800 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -2.6950 -2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -2.2070 -2.9120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 -4.2260 -2.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6660 -4.4870 -2.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 -4.9810 -2.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -4.8810 -2.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5930 -5.2690 -0.5910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 -4.5250 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1310 -4.7170 -0.6620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0530 -5.8020 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0750 -4.2100 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9040 -3.5110 -0.5070 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4340 2.4180 -2.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 0.0300 -2.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6470 -0.8370 -0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1230 1.5500 -0.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 3.3350 -1.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3270 5.4940 -1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 5.9800 -2.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 7.8630 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 7.9800 -0.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 8.6930 1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2480 7.6130 2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 6.8430 1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1480 6.2290 2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -2.5510 -1.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5530 -4.6150 -3.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -6.0400 -2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1300 -3.8600 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4800 -5.5290 -2.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5330 -5.0680 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -6.3490 -0.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6890 -3.4570 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3690 -4.8930 1.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1130 -4.5510 1.3670 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 17 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 16 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 26 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 52 1 0 0 0 0 M CHG 1 52 -1 M END