BTIK35 -OEChem-04022101273D 82 85 0 0 0 0 0 0 0999 V2000 -4.5220 1.8710 0.1111 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6108 3.6370 -1.8305 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6645 -3.4834 0.1907 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.6808 -0.9977 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0735 2.7083 0.4026 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3474 0.3886 2.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3647 1.5391 1.4980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 3.0172 -0.3394 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3422 -3.4076 -1.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0667 -3.8961 0.2413 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6429 -3.0264 -1.4321 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2091 -1.2660 -1.9163 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5748 -2.7418 -1.8278 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7074 -3.0598 -0.8564 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2980 -3.6768 -1.7208 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3567 -2.5201 -2.0425 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7900 -4.3975 0.9104 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3979 -0.7623 -1.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4461 -3.7301 1.1974 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9905 0.6464 -0.5633 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6237 -2.4760 2.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3874 0.6857 0.8467 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7152 -1.7843 2.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0416 2.1041 1.2951 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5436 -0.5559 3.2033 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7002 2.4045 0.5279 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0469 1.2776 1.5856 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5291 3.6332 -0.6148 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9143 1.8430 0.7524 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4402 2.7338 -0.2243 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2856 1.5542 0.8635 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3727 3.3198 -1.0769 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1953 2.1540 -0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 3.0377 -0.9729 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 0.9537 1.1346 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8886 2.9560 -3.0525 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2119 -4.4023 -1.6794 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -2.8161 -1.4319 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5219 -3.6962 1.2164 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1829 -4.9632 0.0117 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1962 -3.5708 -0.6605 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2477 -3.0057 -2.3478 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6062 -0.9881 -2.9011 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -0.4362 -1.5316 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7873 -3.1147 -2.8348 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4375 -1.6558 -1.8929 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1186 -2.1292 -0.4485 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5232 -3.5997 -1.3478 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9305 -4.2186 -0.8413 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3650 -4.3883 -2.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5302 -2.5007 -1.3241 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9272 -2.6142 -3.0451 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2433 -4.6641 1.8743 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6393 -5.3383 0.3663 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8618 -0.7039 -1.9939 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1677 -1.1323 -0.3118 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0693 -3.4821 0.2636 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1956 -4.4443 1.7279 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3032 1.0756 -1.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8871 1.2792 -0.5808 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0885 -2.7492 3.0114 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -1.7770 1.5552 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4951 0.0522 0.8933 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 0.2623 1.5576 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1752 -1.5008 1.3603 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4022 -2.4837 2.8062 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6743 2.0919 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9598 2.7045 1.3264 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5166 -0.1069 3.4337 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1107 -0.8614 4.1633 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2151 0.5814 3.0602 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1200 4.6336 -0.4362 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2233 3.3020 -1.6135 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6206 3.7258 -0.6257 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6064 0.8507 1.6212 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0328 4.0151 -1.8431 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9931 0.8442 1.0771 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6779 1.3441 2.1325 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4779 -0.0409 0.9669 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6071 3.5524 -3.6215 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3281 1.9731 -2.8551 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9757 2.8470 -3.6465 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 1 35 1 0 0 0 0 2 34 1 0 0 0 0 2 36 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 3 17 1 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 18 1 0 0 0 0 5 24 1 0 0 0 0 5 26 1 0 0 0 0 5 28 1 0 0 0 0 6 25 1 0 0 0 0 6 27 1 0 0 0 0 6 71 1 0 0 0 0 7 26 1 0 0 0 0 7 27 2 0 0 0 0 8 26 2 0 0 0 0 8 30 1 0 0 0 0 9 13 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 14 1 0 0 0 0 10 39 1 0 0 0 0 10 40 1 0 0 0 0 11 15 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 16 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 45 1 0 0 0 0 13 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 19 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 20 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 21 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 22 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 21 23 1 0 0 0 0 21 61 1 0 0 0 0 21 62 1 0 0 0 0 22 24 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 25 1 0 0 0 0 23 65 1 0 0 0 0 23 66 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 27 29 1 0 0 0 0 28 72 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 30 32 2 0 0 0 0 31 33 1 0 0 0 0 31 75 1 0 0 0 0 32 34 1 0 0 0 0 32 76 1 0 0 0 0 33 34 2 0 0 0 0 35 77 1 0 0 0 0 35 78 1 0 0 0 0 35 79 1 0 0 0 0 36 80 1 0 0 0 0 36 81 1 0 0 0 0 36 82 1 0 0 0 0 M END $$$$