IFLAB-ZINC04554447 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 -2.1010 1.0500 -1.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -0.3290 -2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -0.6750 -2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4790 -2.0630 -3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -2.4070 -3.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -3.7100 -4.6030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -4.8720 -3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 -4.9900 -2.6590 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 -6.1320 -4.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 -6.0680 -5.9540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3130 -7.3020 -4.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3310 -8.6390 -4.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -8.8920 -5.6670 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3340 -8.3800 -5.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -10.3630 -5.8440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7930 -11.3760 -5.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -12.7230 -6.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -13.0350 -6.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 -12.0670 -6.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1320 -10.7320 -6.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6770 -12.5790 -6.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3760 -13.9860 -6.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 -14.2800 -6.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -8.7920 -7.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6990 -7.8550 -9.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8710 -7.6030 -9.7910 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8940 -6.9740 -9.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -7.8610 -7.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 1.1050 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 1.8240 -2.6380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1380 1.2770 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -1.0740 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6460 -0.3600 -3.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1830 0.0760 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -0.6390 -2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -2.8150 -2.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1150 -2.1040 -4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 -1.6800 -4.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 -2.3990 -3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -3.7810 -5.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 -7.1970 -2.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -9.3190 -3.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3300 -8.8270 -4.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -11.1330 -5.7200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3720 -13.4980 -6.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9350 -10.0020 -6.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7230 -14.3290 -7.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9180 -14.5340 -5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -8.9450 -7.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -9.7480 -8.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -8.3200 -9.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2820 -6.9030 -8.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7510 -6.7990 -9.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5370 -5.9960 -8.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -8.8180 -8.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -7.3540 -7.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 -8.1690 -6.9820 N 0 3 0 0 0 0 0 0 0 0 0 0 1.7270 -7.2310 -6.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 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 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 5 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 57 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 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 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 24 25 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 1 57 1 M END