B6P4UX -OEChem-04012118492D 44 46 0 0 0 0 0 0 0999 V2000 6.2524 1.3874 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.0614 -0.2003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2524 1.3874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2524 1.3874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5714 -2.8739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2524 2.3874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 -1.8559 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3864 2.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1184 2.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3864 3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1184 3.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2524 4.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2524 0.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4434 -0.2003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7524 -1.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7524 -1.1514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1646 -1.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3402 -1.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -2.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -2.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -3.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.3694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -4.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -4.2829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7758 2.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1743 2.3048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3305 2.3048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7290 2.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1743 4.4701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7758 3.7798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7290 3.7798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3305 4.4701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6509 4.8624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8539 4.8624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8537 -0.0087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8386 -2.3248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7046 -2.4620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8418 -1.5960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9179 -1.2895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 -1.9940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6056 -3.6432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -3.3046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 -4.9538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 -4.7845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 6 1 0 0 0 0 1 13 1 0 0 0 0 2 13 1 0 0 0 0 2 16 1 0 0 0 0 5 17 2 0 0 0 0 6 8 1 0 0 0 0 6 9 1 0 0 0 0 7 17 1 0 0 0 0 7 19 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 1 0 0 0 0 9 27 1 0 0 0 0 9 28 1 0 0 0 0 10 12 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 18 36 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 20 22 1 0 0 0 0 20 40 1 0 0 0 0 21 23 2 0 0 0 0 21 41 1 0 0 0 0 22 24 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 M END $$$$