IBS-ZINC04137409 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.9690 0.6530 -1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 0.3720 1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 2.6090 0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 3.3810 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 4.8110 -0.6190 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6500 5.7790 -1.4330 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6040 5.4460 -1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7660 7.0680 -0.6500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7130 6.8240 0.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0460 5.3660 0.4530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7390 4.8070 1.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 7.6090 1.2650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1270 8.2290 -0.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2980 9.2820 0.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 8.4930 -1.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6710 9.0140 -3.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 9.3200 -4.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 9.1280 -3.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 8.6240 -2.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1840 8.2980 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4010 8.4110 -2.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3610 8.8820 -3.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1990 5.8550 -2.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 5.6450 -3.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8200 5.7120 -5.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 5.9850 -5.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 6.1950 -4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5540 6.1320 -3.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6880 6.5330 -4.7050 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.0480 -0.4370 -1.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 0.9670 -1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 1.0910 -2.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 0.6270 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1520 -0.7000 0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 0.6720 1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 2.9010 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8400 2.8030 1.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 3.2190 -1.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4380 3.0370 -0.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7540 10.0300 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7350 9.1880 -3.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1620 9.7200 -5.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2480 9.3870 -4.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 7.9160 -0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2910 8.3280 -4.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2590 9.9600 -3.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 8.7010 -3.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 5.4410 -3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 5.5570 -6.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 6.0360 -6.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2490 6.2980 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6000 1.1110 -0.1200 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5960 0.8530 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 52 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 2 52 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 3 52 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 23 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 11 2 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 40 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 41 1 0 0 0 0 17 18 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 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 20 44 1 0 0 0 0 21 22 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 51 1 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END