IFLAB-ZINC04138641 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 -0.0400 1.5360 -0.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 0.0070 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -0.5100 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -0.5320 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 -2.0540 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 -2.6910 -0.0480 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.8040 -4.4140 -0.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6320 -4.9800 -0.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 -6.2520 -0.5270 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0360 -6.5780 -0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7400 -5.4110 -0.2540 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 -5.2670 -0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8470 -5.1870 -1.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2600 -5.0460 -1.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9730 -4.9620 -2.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -7.9400 -0.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5230 -8.4890 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7990 -9.7660 -0.0890 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4280 -10.3590 0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 -10.0900 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -8.9660 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -9.0070 -2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 -10.1510 -3.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1160 -11.2600 -3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 -11.2370 -1.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 1.9200 -0.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 1.9040 -0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 1.8740 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.3310 -0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8140 -0.1270 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3310 -0.1720 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 -1.6000 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8750 -0.2690 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0390 -0.0940 -0.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9880 -2.3170 -1.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 -2.4920 0.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5840 -6.1270 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4060 -4.3560 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4520 -4.3270 -2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6310 -6.0980 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8020 -5.8680 -3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0390 -4.8560 -2.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6230 -4.0970 -3.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -7.9900 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -8.1450 -2.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -10.1840 -4.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -12.1510 -3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5570 -12.1050 -1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 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 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 25 48 1 0 0 0 0 M END