IFLAB-ZINC04272276 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 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 3 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 -2.5700 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -2.0640 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -0.0480 -1.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4850 0.0620 -1.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1080 -0.2410 -0.1620 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2060 0.5560 -2.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 0.8590 -3.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 0.6760 -2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5100 0.3740 -1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7830 0.6140 -1.6640 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.8410 1.0820 -2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5270 1.1500 -3.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2840 1.5990 -4.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3410 1.9800 -5.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6390 1.9180 -5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8940 1.4660 -3.7850 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9480 0.4060 -0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5360 -0.9560 -1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0310 -1.6800 -1.9010 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6230 -1.3670 -0.3870 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2140 -2.6920 -0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3900 -3.4000 0.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1040 -2.5420 1.6090 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4260 -1.3210 1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2480 -0.5080 0.6300 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 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2900 -2.4020 2.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6580 -3.6600 1.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 -2.2190 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -2.4150 -0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -2.4410 0.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 0.1940 -1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1970 0.0030 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2730 1.6490 -5.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1560 2.3300 -6.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4600 2.2200 -5.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9090 1.4230 -3.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6420 0.4690 0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6950 1.1720 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1850 -2.5770 -1.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5530 -3.2770 -1.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9520 -4.3230 0.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4120 -3.6310 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0130 -0.7470 2.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4480 -1.5440 2.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6090 0.3520 0.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2220 -0.1690 0.2760 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 1 0 0 0 0 2 4 1 0 0 0 0 2 8 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 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 42 1 0 0 0 0 7 43 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 44 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 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 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 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 1 0 0 0 0 28 29 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 32 59 1 0 0 0 0 M END