IBS-ZINC04728606 MOE2007 3D Structure written by MMmdl. 53 56 0 0 1 0 0 0 0 0999 V2000 -3.7440 5.9470 2.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 6.9260 2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 6.7510 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5030 5.6030 1.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4910 4.6120 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6060 4.7860 1.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2890 5.4100 0.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 4.9720 -2.3040 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9460 3.4520 -2.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4370 2.9890 -2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6620 3.3220 -4.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 4.8140 -4.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8740 5.3530 -3.7810 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6240 4.8810 -4.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9710 6.8670 -4.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 7.6500 -3.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 0.9670 7.3000 -3.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 7.4090 -1.5900 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7340 8.1210 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8600 9.6150 -1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 9.8720 -2.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 9.1470 -3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 7.9780 -1.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7250 8.4660 -0.9510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6760 5.1910 -2.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8200 5.3280 -1.9390 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6120 6.0840 3.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 7.8290 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 7.5320 1.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4180 3.6770 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 4.0130 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 5.9180 0.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 4.3580 0.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1210 3.1250 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6840 2.8860 -2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 3.4500 -1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5210 1.9050 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6670 3.0060 -4.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 2.7660 -4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 5.0170 -5.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 5.3240 -3.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0090 7.2020 -3.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6950 7.0760 -5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 8.0550 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6990 7.6350 -0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 10.1520 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7180 10.0360 -0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9790 10.9490 -2.8100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 9.5380 -2.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 9.6080 -3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 9.2740 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 5.8420 -1.3370 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6390 5.6080 -1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 7 52 1 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 25 1 0 0 0 0 8 52 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 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 22 50 1 0 0 0 0 22 51 1 0 0 0 0 23 24 3 0 0 0 0 25 26 3 0 0 0 0 52 53 1 0 0 0 0 M CHG 1 52 1 M END