NIH-ZINC04057354 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -7.9940 -9.4480 7.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6660 -9.0980 6.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7930 -7.8240 5.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -7.3690 5.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6780 -8.0180 5.1720 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 -6.1930 4.5090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5760 -5.6830 3.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9650 -5.4120 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 -4.6160 2.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3800 -5.1260 3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9930 -5.4000 4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2510 -3.4410 1.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2420 -2.9780 1.1670 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -2.7140 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5540 -1.3180 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7520 -0.6420 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9340 -1.3410 1.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9230 -2.7300 1.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7240 -3.4180 1.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1220 -3.4330 1.1110 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.1450 -2.8860 0.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3550 -3.3960 0.2250 N 0 0 0 0 0 0 0 0 0 0 0 0 -14.2900 -2.5770 -0.5140 C 0 0 3 0 0 0 0 0 0 0 0 0 -14.6940 -1.8100 0.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.4370 -3.2200 -1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7990 -1.9710 -2.6000 S 0 0 0 0 0 0 0 0 0 0 0 0 -15.6470 -2.5690 -3.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.0000 -1.2840 -2.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.3480 -0.8770 -2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4220 -1.8840 -1.6260 C 0 0 3 0 0 0 0 0 0 0 0 0 -13.0860 -2.6180 -2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0640 -1.3590 -0.5630 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.8990 -10.4040 7.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2520 -8.6720 7.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7780 -9.5180 6.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8830 -9.0280 7.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 -9.8740 5.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2380 -4.7580 4.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7790 -6.4260 3.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -4.8580 1.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1310 -6.3570 1.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1770 -4.3830 3.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7190 -6.0510 2.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7920 -5.9560 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8310 -4.4550 5.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6340 -0.7690 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7670 0.4370 1.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8680 -0.8060 1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7130 -4.4970 1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2320 -4.3050 1.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.1190 -4.1620 -1.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -16.3050 -3.3680 -0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.9260 -0.4770 -3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.6110 -0.0760 -1.5650 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 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 8 41 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 47 1 0 0 0 0 17 18 2 0 0 0 0 17 48 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 21 22 2 0 0 0 0 21 32 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 M END