B2ID7S -OEChem-04012116232D 44 47 0 1 0 0 0 0 0999 V2000 6.7603 -2.6869 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.6591 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.8966 -2.6869 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2247 1.8839 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0872 -3.1352 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3120 -4.3600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4836 2.8498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7424 3.8157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0657 2.7735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8825 2.8586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0058 4.7984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9318 1.1768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6730 0.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3801 -0.4962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7071 -0.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8284 -2.1693 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1213 -1.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5355 -1.4622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4483 -1.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1554 -1.7210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8625 -2.4281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5015 -1.7210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0532 -3.3940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1927 4.2419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5754 3.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8811 2.1816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0628 2.2654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3998 3.2003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3236 5.3307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3926 4.8903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6259 1.7234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4938 0.9148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2875 1.6847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -0.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7976 -0.9003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0277 -1.1066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8494 -1.1744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7020 -1.8292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2636 -2.5886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0230 -3.0270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1191 -1.6670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5555 -1.1034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9109 -4.5204 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8736 -4.7984 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 15 1 0 0 0 0 3 20 1 0 0 0 0 4 7 1 0 0 0 0 4 12 1 0 0 0 0 4 31 1 0 0 0 0 5 16 1 0 0 0 0 5 23 2 0 0 0 0 6 23 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 24 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 17 1 0 0 0 0 14 34 1 0 0 0 0 15 19 2 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 1 0 0 0 17 20 2 0 0 0 0 18 22 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 M END $$$$