IBS-ZINC06427792 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 0.2040 1.6130 1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2690 0.1880 1.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0780 -0.8540 2.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -2.1800 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3400 -2.4930 0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 -1.4390 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -0.1130 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -3.9430 0.0240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1350 -4.5860 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6790 -4.3680 -0.6420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2780 -4.5290 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2090 -4.4750 -2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8220 -4.6440 -3.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6970 -4.1890 -0.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -4.1250 -0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7410 -2.7780 -1.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 -3.0520 0.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8450 -1.6120 -1.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0280 -4.7050 -3.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 -5.6920 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4310 -6.6850 -0.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 -5.7540 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -4.8290 1.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 -5.3290 1.8940 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -6.5440 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2480 -6.8650 0.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 -8.1040 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0770 -9.0320 0.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2350 -8.7270 0.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3630 -7.5330 1.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6550 -3.4780 1.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4320 1.6870 2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 2.2310 1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 2.0190 1.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -0.6400 3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3100 -2.9670 2.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -1.6280 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 0.6860 -0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -4.9240 -1.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 -4.3430 0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -1.9760 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4380 -2.5000 -2.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -2.2410 0.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5240 -4.0220 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9460 -3.0590 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -1.5490 -2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5650 -0.7340 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9310 -1.7320 -1.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -3.6080 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 -8.2800 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0120 -10.0040 -0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9980 -9.4920 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2250 -7.3000 2.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6210 -3.4860 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2810 -3.1400 2.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7570 -2.7490 1.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2590 -2.8370 -1.0460 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.5410 -3.6330 -1.6360 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 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 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 37 1 0 0 0 0 7 38 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 16 57 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 57 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 18 57 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 31 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 29 52 1 0 0 0 0 30 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END