D0K4LW -OEChem-09301911102D 42 44 0 0 0 0 0 0 0999 V2000 10.9055 0.4516 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 -0.1154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8669 -3.9070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.1634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.6634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1634 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 -0.4244 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.6634 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -0.4244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6859 -2.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 -1.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2791 -3.0980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1013 -0.7845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0524 -0.4755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2603 0.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7955 -1.1446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2113 0.8117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7465 -0.8356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9545 0.1426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.1634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1999 -2.5311 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1166 -1.7385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7336 -1.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7651 -2.7513 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8484 -3.5440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6127 -1.1662 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3924 -1.3319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 1.3534 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7995 0.9175 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6666 -1.7510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.7834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.9734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3402 1.4181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2073 -1.2504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6147 -4.4734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 4.4734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 2 10 1 0 0 0 0 2 15 1 0 0 0 0 3 14 1 0 0 0 0 3 41 1 0 0 0 0 4 26 1 0 0 0 0 4 42 1 0 0 0 0 5 26 2 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 7 12 2 0 0 0 0 8 13 2 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 9 12 1 0 0 0 0 11 14 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 13 17 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 19 2 0 0 0 0 16 20 1 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 21 1 0 0 0 0 18 26 1 0 0 0 0 19 23 1 0 0 0 0 19 35 1 0 0 0 0 20 24 2 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 38 1 0 0 0 0 23 25 2 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 M END $$$$