1B3 CCTOOLS-0919241033 47 49 0 0 1 0 0 0 0 0999 V2000 -7.6220 -0.0540 -1.1280 CL 0 0 0 0 0 -6.0880 0.3140 -0.4040 C 0 0 0 0 0 -5.0600 -0.4520 -0.6880 N 0 0 0 0 0 -6.0040 1.3600 0.4060 N 0 0 0 0 0 -4.8620 1.6940 0.9890 C 0 0 0 0 0 -4.7900 2.7840 1.8300 N 0 0 0 0 0 -3.7170 0.9020 0.7270 C 0 0 0 0 0 -3.8560 -0.2020 -0.1500 C 0 0 0 0 0 -2.7410 -1.0000 -0.4330 C 0 0 0 0 0 -2.4730 1.1870 1.3020 C 0 0 0 0 0 -1.4010 0.3970 1.0210 C 0 0 0 0 0 -1.5230 -0.6950 0.1500 C 0 0 0 0 0 -0.3370 -1.5370 -0.1450 C 0 0 0 0 0 0.8940 -1.2380 0.4370 C 0 0 0 0 0 -0.4510 -2.6320 -0.9990 C 0 0 0 0 0 0.6550 -3.4110 -1.2700 C 0 0 0 0 0 1.8760 -3.1070 -0.6940 C 0 0 0 0 0 1.9940 -2.0250 0.1600 C 0 0 0 0 0 3.5530 -1.6450 0.8880 S 0 0 0 0 0 3.2740 -0.9060 2.0690 O 0 0 0 0 0 4.3020 -2.8530 0.8850 O 0 0 0 0 0 4.3340 -0.6080 -0.1390 N 0 0 0 0 0 3.8320 0.6230 -0.3640 C 0 0 0 0 0 2.8090 0.9700 0.1850 O 0 0 0 0 0 4.5440 1.5670 -1.2990 C 0 0 0 0 0 3.6080 2.6050 -1.7510 N 0 0 0 0 0 5.7180 2.2210 -0.5680 C 0 0 0 0 0 6.3630 3.2700 -1.4750 C 0 0 0 0 0 5.2450 2.8490 0.6250 O 0 0 0 0 0 -5.5820 3.3180 2.0020 H 0 0 0 0 0 -3.9480 3.0180 2.2510 H 0 0 0 0 0 -2.8310 -1.8450 -1.0990 H 0 0 0 0 0 -2.3650 2.0300 1.9680 H 0 0 0 0 0 -0.4420 0.6200 1.4670 H 0 0 0 0 0 0.9870 -0.3940 1.1030 H 0 0 0 0 0 -1.4030 -2.8700 -1.4490 H 0 0 0 0 0 0.5680 -4.2600 -1.9310 H 0 0 0 0 0 2.7390 -3.7200 -0.9080 H 0 0 0 0 0 5.1530 -0.8860 -0.5790 H 0 0 0 0 0 4.9160 1.0130 -2.1610 H 0 0 0 0 0 3.2490 3.1330 -0.9700 H 0 0 0 0 0 4.0430 3.2130 -2.4290 H 0 0 0 0 0 6.4550 1.4600 -0.3100 H 0 0 0 0 0 5.6260 4.0310 -1.7330 H 0 0 0 0 0 7.1990 3.7360 -0.9540 H 0 0 0 0 0 6.7240 2.7910 -2.3850 H 0 0 0 0 0 4.5840 3.5390 0.4720 H 0 0 0 0 0 1 2 1 0 0 0 2 4 1 0 0 0 3 2 2 0 0 0 3 8 1 0 0 0 4 5 2 0 0 0 5 6 1 0 0 0 6 30 1 0 0 0 6 31 1 0 0 0 7 5 1 0 0 0 7 10 2 0 0 0 8 7 1 0 0 0 9 8 2 0 0 0 9 12 1 0 0 0 9 32 1 0 0 0 10 33 1 0 0 0 11 10 1 0 0 0 11 34 1 0 0 0 12 11 2 0 0 0 13 12 1 0 0 0 13 14 2 0 0 0 14 35 1 0 0 0 15 13 1 0 0 0 15 36 1 0 0 0 16 15 2 0 0 0 16 17 1 0 0 0 16 37 1 0 0 0 17 18 2 0 0 0 17 38 1 0 0 0 18 14 1 0 0 0 18 19 1 0 0 0 19 21 2 0 0 0 20 19 2 0 0 0 22 23 1 0 0 0 22 19 1 0 0 0 22 39 1 0 0 0 23 24 2 0 0 0 25 23 1 0 0 0 25 26 1 0 0 0 25 40 1 0 0 0 26 41 1 0 0 0 26 42 1 0 0 0 27 25 1 0 0 0 27 43 1 0 0 0 28 27 1 0 0 0 28 44 1 0 0 0 28 45 1 0 0 0 28 46 1 0 0 0 29 27 1 0 0 0 29 47 1 0 0 0 M END $$$$