B4U5DJ -OEChem-04022105382D 39 42 0 1 0 0 0 0 0999 V2000 3.5800 -2.9025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0938 -1.4324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6051 -0.4634 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9989 0.3414 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 2.3132 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 2.5084 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.9372 -1.2077 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.9587 -1.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2479 -2.1582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2909 -1.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 0.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5938 -0.5664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6015 -2.6963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 1.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 1.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0938 -1.4324 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.5298 2.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 2.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 0.7037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5938 -2.2985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7446 -0.6184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1900 -0.4262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4324 -0.6738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6304 -2.6461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7948 -1.8662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9083 -1.2578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7439 -2.0378 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9877 -2.7836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 -3.3159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4038 -1.9694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7988 2.3184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 0.1144 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0568 -1.9885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2838 -2.8354 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1307 -2.6085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 2.9025 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 1.5084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4038 -1.9694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 13 1 0 0 0 0 16 2 1 6 0 0 0 2 39 1 0 0 0 0 7 3 1 6 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 12 2 0 0 0 0 4 14 1 0 0 0 0 5 17 1 0 0 0 0 5 21 1 0 0 0 0 5 37 1 0 0 0 0 6 17 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 22 1 0 0 0 0 8 10 1 0 0 0 0 8 23 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 13 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 14 1 0 0 0 0 11 15 2 0 0 0 0 12 16 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 18 2 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 31 1 0 0 0 0 18 32 1 0 0 0 0 19 21 2 0 0 0 0 19 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$