IFLAB-ZINC02974558 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 64 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1040 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -0.5340 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 -1.9160 0.0270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4870 -2.6700 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -2.0210 -0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5460 -4.0410 0.0060 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5660 -4.7950 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -4.0600 2.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -4.2700 3.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 -5.8240 3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -6.5900 3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -7.1390 1.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 -6.0850 0.7900 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6420 -6.3000 -0.6650 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5990 -4.8580 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9110 -6.9920 -1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0790 -6.7950 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2440 -7.4280 -0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2460 -8.2630 -1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0730 -8.4580 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -7.8160 -2.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0540 -9.2670 -3.6880 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1460 -10.1820 -3.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4510 -9.4180 -3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3990 -8.8860 -2.2390 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4940 -7.0420 -1.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8740 -2.5420 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0360 -1.7090 0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3290 1.1820 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5110 0.0480 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3400 -2.5970 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6580 -4.4130 2.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3940 -2.9950 2.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6600 -3.8560 4.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6480 -3.8040 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4660 -6.0710 4.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6520 -6.1340 2.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8420 -5.9220 3.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6670 -7.4060 3.9430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8030 -7.7820 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -7.7350 1.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4980 -4.6340 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7060 -4.7040 -1.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0790 -6.1460 0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -7.2730 -0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 -7.9640 -2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1560 -10.5890 -4.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0430 -10.9920 -3.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5510 -8.6040 -4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2990 -10.0960 -3.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4600 -7.2090 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0230 -1.0840 0.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0410 -1.0750 -0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9300 -2.3330 0.0580 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 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 1 0 0 0 0 10 16 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 29 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 M CHG 1 9 1 M END