IFLAB-ZINC05143539 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 53 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 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -4.0500 -0.0150 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 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5830 -8.1920 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -9.3280 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -9.1680 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0900 -7.9580 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -6.8530 -0.0390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -7.8320 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2790 -6.6780 -0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6120 -6.9620 -0.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3200 -6.2990 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 -8.3260 -0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5410 -8.9330 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4330 -10.3230 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 -11.0950 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8250 -10.4970 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9470 -9.1250 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -10.6830 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5800 -10.8140 -0.0290 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -11.7700 -0.0540 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -7.9750 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6350 -8.6620 -0.0080 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 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 -4.6960 -0.0270 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 2.8560 -5.6850 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4600 -10.7910 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4920 -12.1720 -0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7120 -11.1130 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9270 -8.6690 -0.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -11.6660 -0.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9670 -12.6580 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 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 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 10 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 32 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 30 1 0 0 0 0 13 14 1 0 0 0 0 13 27 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 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 2 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 48 1 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 32 33 2 0 0 0 0 M END