B21GKE -OEChem-04012112172D 55 57 0 1 0 0 0 0 0999 V2000 5.6103 0.4551 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2136 0.3295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4813 1.6924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1921 0.5357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0596 4.0059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -4.0059 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 -0.0830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -1.9840 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8564 2.0243 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -1.4459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.3964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -1.2397 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -2.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8349 2.2305 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.2781 -0.2892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1456 3.1810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 0.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1241 3.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5458 1.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5028 1.4862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4348 4.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7920 2.6430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4133 4.5440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7705 2.8492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0811 3.7997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 -0.8263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 -1.3586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7748 -1.8290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -3.2012 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6423 1.6412 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -4.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1250 3.8007 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5318 3.2684 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5812 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.8212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5467 1.4872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9534 0.9549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6707 -0.5444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2420 -1.8562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4427 -2.5733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4424 2.4858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.3912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.0112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0207 4.7992 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5993 2.0536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6059 5.1333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1845 2.3877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8954 1.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2522 4.5952 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 2 0 0 0 0 2 23 2 0 0 0 0 3 26 1 0 0 0 0 3 54 1 0 0 0 0 4 26 2 0 0 0 0 5 31 1 0 0 0 0 5 55 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 6 37 1 0 0 0 0 7 17 1 0 0 0 0 7 21 1 0 0 0 0 7 44 1 0 0 0 0 12 8 1 1 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 16 9 1 1 0 0 0 9 23 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 13 1 0 0 0 0 11 15 2 0 0 0 0 12 17 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 19 2 0 0 0 0 14 20 2 0 0 0 0 15 35 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 16 36 1 0 0 0 0 18 22 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 24 1 0 0 0 0 19 40 1 0 0 0 0 20 25 1 0 0 0 0 20 41 1 0 0 0 0 21 23 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 27 2 0 0 0 0 22 28 1 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 49 1 0 0 0 0 27 29 1 0 0 0 0 27 50 1 0 0 0 0 28 30 2 0 0 0 0 28 51 1 0 0 0 0 29 31 2 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 M END $$$$