IFLAB-ZINC04518747 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -2.3960 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -3.7680 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 -4.5980 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -4.0500 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -2.6790 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 -5.9920 -0.0110 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -6.9270 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5840 -8.1930 -0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -9.3280 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -9.1670 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 -7.9580 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -6.8540 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5660 -7.8320 -0.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -8.9740 -0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -8.8540 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3270 -7.5990 -0.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 -6.4590 -0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -6.5710 -0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1140 -5.2370 -0.0790 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6730 -7.4860 -0.1030 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.3710 -10.6840 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5790 -10.8150 -0.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5750 -11.7710 -0.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -7.9750 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -8.6620 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -6.6450 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 -6.1140 0.0230 O 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 -3.6380 -1.7500 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9280 -4.1940 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -4.6960 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.2520 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9090 -9.9530 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3580 -9.7390 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5440 -5.6840 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3900 -11.6660 -0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -12.6580 -0.0500 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 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 25 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 43 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 30 31 2 0 0 0 0 M END