PUBCHEM-ZINC05133969 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -1.6790 -4.7240 -3.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -3.9740 -5.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7240 -4.4990 -6.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9270 -3.8290 -7.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -2.6330 -7.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -2.0990 -6.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -2.7510 -5.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -2.1730 -4.3250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -0.6150 -3.7200 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -0.4210 -2.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6170 0.3380 -4.8120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3360 -0.7460 -3.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3320 -0.2240 -3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 -0.2620 -3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0080 -0.8070 -2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0260 -1.3150 -1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6650 -1.3150 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6190 -1.8750 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 -1.8660 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 0.2720 -4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3800 0.7180 -5.6590 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.9900 -4.4940 -8.4080 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.6180 -4.8980 -3.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1270 -4.1660 -2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 -5.7070 -3.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -5.4340 -5.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4200 -2.1060 -8.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 -1.1690 -6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -2.7950 -3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 0.2140 -4.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0580 -0.8290 -2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -1.0670 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -2.5900 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8590 -2.4410 -1.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3640 -2.9540 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9080 -1.4190 0.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5360 -1.6410 0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9540 0.2330 -4.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 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 26 1 0 0 0 0 4 5 1 0 0 0 0 4 22 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 10 2 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 2 0 0 0 0 M CHG 1 21 -1 M END