IBS-ZINC03678482 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -1.1050 1.6490 -1.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0930 0.2420 -1.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -0.3380 -2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3460 0.3150 -2.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 -0.4070 -2.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 -1.7860 -2.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.4570 -2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 -1.7190 -2.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1900 -3.9580 -2.7840 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9740 -4.2490 -3.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -4.5090 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7450 -5.6430 -2.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -5.8130 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9650 -6.7460 -3.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9820 -6.6170 -4.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9570 -5.5800 -5.5790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -4.6440 -5.5840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9100 -4.7830 -4.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -4.0170 -4.4020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5320 -3.2090 -4.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2250 -6.4670 -1.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2760 -6.1950 -1.5240 C 0 0 3 0 0 0 0 0 0 0 0 0 1.9000 -6.5780 -2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7450 -6.8150 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -6.1480 0.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -8.1650 -0.2350 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 -8.8260 0.9590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5660 -2.5810 -2.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 -1.9290 -2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 1.9210 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7520 2.1830 -2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1410 1.9510 -1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 1.3840 -1.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4530 0.1430 -2.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.2060 -2.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9970 -7.5600 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8000 -7.3330 -4.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7560 -5.4980 -6.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -3.8380 -6.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -6.2340 -0.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -7.5320 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -8.6600 1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4480 -8.4770 1.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -9.8980 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8090 -1.2190 -3.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -1.4410 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5710 -2.6950 -3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5200 -4.6800 -1.5010 N 0 3 0 0 0 0 0 0 0 0 0 0 2.5030 -4.4840 -1.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9710 -4.2660 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 48 1 0 0 0 0 11 12 2 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 21 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 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 2 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 48 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 28 29 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 29 47 1 0 0 0 0 48 49 1 0 0 0 0 48 50 1 0 0 0 0 M CHG 1 48 1 M END