D0K0TY -OEChem-10191522272D 79 82 0 0 0 0 0 0 0999 V2000 13.0258 4.3067 0.0000 Br 0 5 0 0 0 0 0 0 0 0 0 0 12.6190 3.3932 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 7.4323 -2.6043 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 8.5106 1.0453 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.4280 -0.1571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8978 1.6331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6527 -2.6976 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5158 1.6331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4836 -4.3067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2068 2.5842 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 6.5662 -3.1043 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 14.2068 2.5842 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4617 -4.0988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5971 1.4521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3892 2.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9280 0.7089 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4381 2.7392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3767 1.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9334 0.8134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4061 0.0508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2302 3.7174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2427 1.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3457 0.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2792 4.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2427 0.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1087 1.5453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3511 0.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7524 -0.9091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9747 0.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1701 -1.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1087 -0.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9747 1.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7634 -0.7001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1646 -1.7181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8408 -0.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 -2.4226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7068 0.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9890 -3.3362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8408 -1.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5878 -2.3181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5728 -0.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -4.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7068 -1.9547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7068 1.0453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9836 -3.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5728 -1.4547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 -4.0407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0088 2.4518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4755 3.0442 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8185 2.7176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3518 2.1253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7752 2.0203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9781 2.0203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1043 1.4094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3762 1.0852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8669 -0.3641 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1758 -0.7235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8498 3.7390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3165 4.3313 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4708 4.6160 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6895 4.2180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0876 3.4367 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7058 -0.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1087 2.1653 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0990 0.6754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3690 -0.9739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1087 -1.0747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5117 1.3553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1468 -0.6353 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4168 -2.2845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3038 -1.7647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 -1.7517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1098 -0.1447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6534 -4.7116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7068 -2.5747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3834 -3.0623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1098 -1.7647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0423 -4.5422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4 14 1 0 0 0 0 4 18 1 0 0 0 0 4 20 2 0 0 0 0 5 16 1 0 0 0 0 5 20 1 0 0 0 0 5 58 1 0 0 0 0 6 10 1 0 0 0 0 6 45 2 0 0 0 0 7 11 1 0 0 0 0 7 46 2 0 0 0 0 8 12 2 0 0 0 0 8 45 1 0 0 0 0 9 13 2 0 0 0 0 9 46 1 0 0 0 0 10 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 16 2 0 0 0 0 15 17 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 19 1 0 0 0 0 17 21 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 22 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 23 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 57 1 0 0 0 0 21 24 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 22 25 2 0 0 0 0 22 26 1 0 0 0 0 23 27 2 0 0 0 0 23 28 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 24 63 1 0 0 0 0 25 31 1 0 0 0 0 25 64 1 0 0 0 0 26 32 2 0 0 0 0 26 65 1 0 0 0 0 27 33 1 0 0 0 0 27 66 1 0 0 0 0 28 34 2 0 0 0 0 28 67 1 0 0 0 0 29 31 2 0 0 0 0 29 32 1 0 0 0 0 29 35 1 0 0 0 0 30 33 2 0 0 0 0 30 34 1 0 0 0 0 30 36 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 33 70 1 0 0 0 0 34 71 1 0 0 0 0 35 37 1 0 0 0 0 35 39 2 0 0 0 0 36 38 1 0 0 0 0 36 40 2 0 0 0 0 37 41 2 0 0 0 0 37 45 1 0 0 0 0 38 42 2 0 0 0 0 38 46 1 0 0 0 0 39 43 1 0 0 0 0 39 72 1 0 0 0 0 40 44 1 0 0 0 0 40 73 1 0 0 0 0 41 47 1 0 0 0 0 41 74 1 0 0 0 0 42 48 1 0 0 0 0 42 75 1 0 0 0 0 43 47 2 0 0 0 0 43 76 1 0 0 0 0 44 48 2 0 0 0 0 44 77 1 0 0 0 0 47 78 1 0 0 0 0 48 79 1 0 0 0 0 M CHG 6 1 -1 2 1 3 1 4 1 10 -1 11 -1 M END $$$$