IFLAB-ZINC04088581 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -1.9640 0.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8190 -2.3930 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7870 -1.8070 -0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -0.8120 -1.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -0.3790 -2.2520 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.8130 -1.5490 -1.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1560 -2.2410 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7760 -3.3140 0.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3550 -3.0540 1.2500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -4.5900 -0.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1290 -1.7710 -1.9250 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 -1.0330 -2.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0310 -0.1720 -3.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0880 -1.2690 -3.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8440 -2.2550 -2.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1490 -2.4650 -3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7240 -1.7070 -4.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9850 -0.7270 -4.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6700 -0.5050 -4.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5520 0.1400 -5.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8110 -0.4930 -6.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7590 -0.8460 -5.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1520 -2.0070 -4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0750 -0.1660 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7100 -2.2160 1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -2.4820 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8900 -3.4800 0.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 -2.0160 1.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2440 -4.7970 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1150 -5.3000 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6500 -2.4570 -1.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4070 -2.8500 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7340 -3.2280 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0920 0.2620 -4.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8000 1.1190 -5.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8080 0.2580 -6.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.2980 0.2140 -7.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5460 -1.3980 -6.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.8770 0.0180 -4.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.7290 -1.1400 -5.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.1820 -2.9080 -5.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7340 -2.1700 -3.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5080 -0.5370 -2.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1820 0.9160 -1.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -0.5120 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 26 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 20 2 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 26 52 1 0 0 0 0 M END