BW0G9J -OEChem-04012115272D 113114 0 1 0 0 0 0 0999 V2000 6.2619 4.3301 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 0.8660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2619 -2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7619 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 2.5981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 -5.1962 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7619 -6.9282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2619 6.0622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 -1.7320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 -4.3301 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2619 0.8660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.7619 -5.1962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 18.7619 1.7320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 5.1962 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 5.1349 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 3.5254 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 -0.8660 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.2619 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7619 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 -3.4641 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.2619 0.8660 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.7619 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 -3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 -2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2619 -4.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2619 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2619 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2619 -4.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2619 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7619 -5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2619 4.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7619 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7619 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2619 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7619 -5.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2619 2.5981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7619 3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2619 -6.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7619 3.4641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2619 -6.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2619 6.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2619 -6.0622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7619 6.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 4.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.3301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.8301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9519 -1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6793 -1.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3695 -1.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3445 0.2121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6542 0.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1419 -3.4641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.5719 0.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1793 -0.2121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8695 -0.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3445 -3.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6542 -2.8535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3819 -1.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2869 2.1306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2869 1.3335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6793 -4.5422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3695 -4.9407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0719 -0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7368 2.1996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7368 2.9966 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8445 1.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1542 1.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8445 -4.1181 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1542 -3.7196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2869 3.8626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2869 3.0656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6419 -4.3301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.1793 -5.4082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.8695 -5.8067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9519 0.3291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7368 3.9316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.7368 4.7287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1793 1.5200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8695 1.1215 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8445 2.8101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1542 3.2087 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6793 2.3860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3695 1.9875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.0719 -4.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.3819 1.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.4519 2.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3445 3.6762 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6542 4.0747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1419 5.1962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7249 -5.7522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9519 -6.5991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7988 -6.3722 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1793 3.2520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8695 2.8535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2619 -6.6822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8819 -6.0622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.2619 -5.4422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.2988 7.2382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.4519 7.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.2249 6.6182 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 5.7242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.9501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.7101 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 5.1401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 3.5201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 43 1 0 0 0 0 1 48 1 0 0 0 0 2 25 2 0 0 0 0 3 27 2 0 0 0 0 4 33 2 0 0 0 0 5 37 2 0 0 0 0 6 39 2 0 0 0 0 7 44 2 0 0 0 0 8 45 2 0 0 0 0 18 9 1 1 0 0 0 9 27 1 0 0 0 0 9 66 1 0 0 0 0 22 10 1 1 0 0 0 10 25 1 0 0 0 0 10 71 1 0 0 0 0 21 11 1 6 0 0 0 11 39 1 0 0 0 0 11 80 1 0 0 0 0 12 30 1 0 0 0 0 12 37 1 0 0 0 0 12 83 1 0 0 0 0 13 34 1 0 0 0 0 13 44 1 0 0 0 0 13 92 1 0 0 0 0 14 33 1 0 0 0 0 14 93 1 0 0 0 0 14 94 1 0 0 0 0 15 35 1 0 0 0 0 15 45 1 0 0 0 0 15 97 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16109 1 0 0 0 0 17 48 2 0 0 0 0 17 50 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 18 55 1 0 0 0 0 19 20 1 0 0 0 0 19 56 1 0 0 0 0 19 57 1 0 0 0 0 20 23 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 24 1 0 0 0 0 21 27 1 0 0 0 0 21 60 1 0 0 0 0 22 26 1 0 0 0 0 22 33 1 0 0 0 0 22 61 1 0 0 0 0 23 30 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 28 1 0 0 0 0 24 64 1 0 0 0 0 24 65 1 0 0 0 0 26 29 1 0 0 0 0 26 67 1 0 0 0 0 26 68 1 0 0 0 0 28 31 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 29 32 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 30 74 1 0 0 0 0 30 75 1 0 0 0 0 31 34 1 0 0 0 0 31 76 1 0 0 0 0 31 77 1 0 0 0 0 32 35 1 0 0 0 0 32 78 1 0 0 0 0 32 79 1 0 0 0 0 34 81 1 0 0 0 0 34 82 1 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 86 1 0 0 0 0 36 87 1 0 0 0 0 38 40 1 0 0 0 0 38 88 1 0 0 0 0 38 89 1 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 40 90 1 0 0 0 0 40 91 1 0 0 0 0 41 43 1 0 0 0 0 41 95 1 0 0 0 0 41 96 1 0 0 0 0 42 98 1 0 0 0 0 42 99 1 0 0 0 0 42100 1 0 0 0 0 43101 1 0 0 0 0 43102 1 0 0 0 0 44 46 1 0 0 0 0 45 47 1 0 0 0 0 46103 1 0 0 0 0 46104 1 0 0 0 0 46105 1 0 0 0 0 47106 1 0 0 0 0 47107 1 0 0 0 0 47108 1 0 0 0 0 49 50 1 0 0 0 0 49 51 2 0 0 0 0 50 52 2 0 0 0 0 51 53 1 0 0 0 0 51110 1 0 0 0 0 52 54 1 0 0 0 0 52111 1 0 0 0 0 53 54 2 0 0 0 0 53112 1 0 0 0 0 54113 1 0 0 0 0 M END $$$$