IFLAB-ZINC04568656 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 0.5080 1.2020 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -0.1780 2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -0.8190 1.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -0.1370 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 1.2230 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9700 1.9220 0.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 3.4170 0.6690 C 0 0 3 0 0 0 0 0 0 0 0 0 1.5020 3.8030 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 4.2210 1.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 5.6400 1.8360 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 6.5260 1.1090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 6.2130 0.4400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9630 7.9650 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 8.2240 1.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 8.8370 0.4240 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4760 10.2550 0.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 11.0120 1.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 12.5060 1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 13.3190 1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 14.8130 1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 15.3550 1.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6660 14.5030 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 13.0460 1.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 3.1890 0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0830 3.7940 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0670 3.5400 -1.4510 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 4.1170 -2.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 3.5330 -1.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -0.9500 -0.9390 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3430 -2.2260 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -2.1470 0.9960 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 1.7030 2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3600 -0.7290 2.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 1.7210 -1.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 4.1510 2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 3.8090 2.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0450 6.0370 2.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 8.4630 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5630 10.3840 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 10.6170 -0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1650 10.7730 1.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 10.6590 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9070 12.9020 0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8420 15.1090 -0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 15.2690 1.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 16.3940 1.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 15.3640 2.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8300 14.5490 0.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5670 14.9070 1.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6350 12.9590 2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 12.4390 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 3.4250 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 2.1060 0.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 3.3370 0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 4.8740 0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9710 3.8950 -3.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 5.2070 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 2.4510 -1.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 4.0200 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -2.9130 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3490 -2.6280 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 3.7730 0.0060 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.6850 4.8150 0.1180 H 0 0 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 62 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 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 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END