IBS-ZINC06759512 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 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 3 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 0.7310 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0480 -0.9110 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 -1.3690 2.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -1.4190 3.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 -1.0100 3.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -0.5480 2.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0510 -0.6430 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5240 -0.3410 -2.1940 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4650 -1.1640 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -1.2130 -2.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8800 -2.2910 -3.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3230 -3.5560 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -4.4250 -4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0040 -4.0340 -5.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -2.7750 -5.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 -1.8970 -4.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -0.6300 -4.3870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6360 -0.2260 -3.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9030 0.8620 -2.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -6.0100 -4.2270 Cl 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 2.5540 -0.8730 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -1.6890 2.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5900 -1.7770 4.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -1.0490 4.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 -0.2250 2.5230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 -0.7520 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4790 -2.1660 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 -0.5030 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8410 -3.8620 -2.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0500 -4.7170 -6.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0400 -2.4740 -6.5600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 10 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 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 14 15 1 0 0 0 0 14 22 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 24 1 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 M END