NIH-ZINC00337674 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0260 1.5070 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 0.0000 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.6970 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.0790 1.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.7640 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.0680 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0100 -0.6850 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -4.5260 -0.0200 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -4.9130 -1.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6250 -4.9250 1.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5110 -5.0400 -0.0080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -4.7760 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8840 -4.1600 -2.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -5.1940 -1.0470 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4570 -4.8300 -2.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8020 -5.1760 -2.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6450 -4.8090 -3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1120 -4.1050 -4.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 -3.7950 -4.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9860 -4.1550 -3.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1260 -3.6200 -5.4410 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9960 1.8850 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5530 1.8670 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5370 1.8580 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.1610 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -2.6230 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -2.6030 -2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.1410 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -5.5320 0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 -5.7490 -0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1830 -5.7240 -1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6940 -5.0640 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3450 -3.2490 -4.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 29 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 30 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 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 M END