IBS-ZINC01752838 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 1.2350 1.9540 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0780 0.5650 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -0.0400 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9160 -1.4090 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -1.5590 -0.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7100 -0.3530 -1.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -2.7390 -1.2410 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5230 -3.6720 -0.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -2.7940 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2230 -3.0150 -0.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5780 -2.4990 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 -3.2090 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 -2.3340 -0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3110 -1.1400 -0.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8640 -0.3250 -1.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -1.2070 -0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1320 -0.0080 -1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2800 -2.5530 -0.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8140 -3.5880 -0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9580 -1.4090 -0.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3770 -1.5060 -0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9090 -4.6260 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 -3.6270 0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -2.7420 -2.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -2.8520 -3.5660 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1910 -2.6640 -3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0450 -2.6450 -4.7690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7730 -2.6950 -2.5770 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2040 -2.7110 -2.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7030 -4.1220 -3.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1520 -3.6990 -2.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4830 -5.4410 -4.3410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 2.0070 -1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2900 2.3280 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5430 2.6150 0.2130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 0.4500 2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9010 -2.1900 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8440 -0.0280 -2.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 0.9150 -1.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2250 0.0370 -0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6480 -1.7170 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8110 -0.5430 -0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7750 -2.2750 -1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1740 -4.6630 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -5.1570 -0.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9720 -5.1720 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4500 -2.8070 -4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 -2.0510 -3.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 -2.2980 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 -4.7820 -2.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0770 -4.5610 -3.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 -4.3850 -1.8530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9430 -2.6720 -2.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -3.7430 -3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7620 -5.6520 -5.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4460 -6.2070 -3.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4870 -5.3600 -4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -4.1120 -3.7240 N 0 3 0 0 0 0 0 0 0 0 0 0 4.1620 -3.4240 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 28 1 0 0 0 0 9 10 1 0 0 0 0 9 24 2 0 0 0 0 10 11 1 0 0 0 0 10 23 2 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 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 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 50 1 0 0 0 0 30 51 1 0 0 0 0 30 58 1 0 0 0 0 31 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 58 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END