NIH-ZINC06529337 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 1.0790 -6.8540 -6.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2360 -6.2790 -5.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -7.1140 -4.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -8.4790 -4.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -9.2230 -3.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -8.6090 -2.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -7.2400 -2.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0600 -6.5000 -3.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 -6.5500 -1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -5.6300 -1.9500 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4050 -6.9960 -0.2850 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2630 -6.4250 0.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -6.6970 0.5280 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1250 -6.1380 -0.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0270 -8.1790 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6000 -8.6280 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8040 -9.9890 -1.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4270 -10.8660 -0.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8690 -10.4780 1.0630 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6800 -9.1510 1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1250 -6.4330 1.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9370 -5.9080 2.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6590 -4.4910 2.9450 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2590 -4.0960 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -4.6000 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6870 -3.5650 3.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7810 -3.8550 3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8340 -2.9570 4.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8190 -1.7400 3.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7570 -1.4230 2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6940 -2.3220 2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6480 -2.0900 1.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6250 -0.8450 0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3660 -6.0600 -7.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9960 -7.2530 -6.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -7.6240 -7.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -8.9980 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3140 -10.2900 -3.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7810 -9.2180 -1.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -5.4370 -3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7430 -7.7200 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9230 -6.8300 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0590 -5.3500 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8840 -7.9270 -1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2450 -10.3550 -2.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 -11.9380 -0.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2220 -8.8960 2.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2410 -7.5180 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4450 -5.9670 0.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.9980 -6.0940 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6740 -6.4680 3.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1230 -3.0150 3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8570 -4.5450 3.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7670 -4.1340 0.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 -4.4040 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8030 -4.7910 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6590 -3.2050 4.7400 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6370 -1.0350 3.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7960 -0.4660 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5660 -0.0060 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7220 -0.8240 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4860 -0.7480 0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6240 -6.1220 1.6990 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.3150 -6.5690 2.5700 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 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 6 7 2 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 63 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 21 49 1 0 0 0 0 21 63 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 1 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 25 63 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 33 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END