IBS-ZINC04137398 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.3090 0.0880 1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -0.9650 0.6130 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -1.5060 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0370 -1.1300 0.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1480 -1.7730 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9840 -2.7900 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7020 -3.1690 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5910 -2.5260 -0.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4550 -4.2520 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3290 -4.7430 -2.4360 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5780 -4.7630 -3.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0440 -5.0600 -4.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -6.5360 -4.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 -7.0720 -5.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5630 -7.1290 -3.7350 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 -6.1480 -2.8120 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2090 -6.1560 -3.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 -6.4440 -1.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -6.9880 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -7.1590 0.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -6.7820 1.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0160 -6.2440 0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0980 -6.0670 -0.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -8.5790 -3.6220 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6500 -9.1640 -4.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7870 -11.2790 -5.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6510 -12.8010 -5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -13.1900 -6.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -12.6850 -5.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -11.1560 -5.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7260 -4.2440 -5.4530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1750 -0.2590 2.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2160 0.9500 1.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3230 0.4090 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 -0.3470 1.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1490 -1.4810 0.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 -3.2740 -1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4170 -2.8140 -1.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -7.2500 -1.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 -7.5680 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8970 -6.8930 2.4750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8880 -5.9240 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0360 -8.8510 -2.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6870 -8.9870 -3.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4630 -8.7770 -5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6810 -8.9160 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6590 -10.9820 -4.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8400 -10.8470 -6.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 -13.2290 -6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6310 -13.2340 -4.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 -13.0290 -6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -13.1150 -4.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3480 -10.7260 -6.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4260 -10.7810 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3820 -4.0300 -3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5520 -10.6800 -4.7550 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5190 -11.0510 -3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 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 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 38 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 16 1 0 0 0 0 11 55 1 0 0 0 0 12 13 1 0 0 0 0 12 31 2 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 25 56 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 30 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 56 1 M END