B78RWT -OEChem-04022107583D 83 88 0 0 0 0 0 0 0999 V2000 -0.1291 -3.4611 -1.5488 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1277 -2.5620 -0.9475 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1496 -1.3608 -0.4743 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8392 2.0588 1.1068 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0765 -0.1220 0.1093 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9615 1.1425 0.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6706 4.0986 0.4651 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3417 3.0500 1.5429 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3367 -1.4272 -0.5964 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8278 -4.5842 -2.0999 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4139 3.5453 -0.7109 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9572 -1.8095 0.7187 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5007 1.9088 1.0271 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7308 -0.2050 0.0603 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7827 3.2374 -0.6492 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3338 -1.6721 0.9608 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1155 0.7886 0.5083 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9022 -2.4785 -0.9801 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4274 2.7174 -1.7967 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8559 -2.0508 2.2205 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7652 -4.0829 -3.1974 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2162 -5.5367 -2.6786 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6142 -5.2649 -0.9805 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 3.3436 -1.8872 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1077 -2.3133 1.7042 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5564 1.0204 0.6367 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 3.4342 0.5262 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2036 -1.1671 -0.0194 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6843 2.5204 -2.9721 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9861 -2.5555 3.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3249 2.8319 -3.0155 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6212 -2.6853 2.9432 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7962 2.4094 -1.7352 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2324 -1.9134 2.4629 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8853 3.1228 0.5693 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5685 -1.0376 0.2386 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5193 2.6116 -0.5592 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0820 -1.4101 1.4774 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8511 0.1228 0.2438 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2812 0.5551 0.4133 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9604 0.2699 1.5978 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9287 1.2410 -0.6142 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2871 0.6708 1.7548 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2556 1.6419 -0.4572 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9347 1.3568 0.7273 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2283 4.9320 0.9096 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2703 4.5550 0.1264 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2477 2.6463 2.0085 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2073 3.5474 2.3529 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7013 -0.4798 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6313 -2.1800 -1.3346 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1944 0.7583 0.5077 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2652 -3.3436 -3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6901 -3.6263 -2.8359 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0825 -4.9152 -3.8373 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 -5.8587 -1.9024 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8136 -5.0357 -3.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2431 -6.4268 -3.1206 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0026 -5.3627 -0.0758 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9219 -6.2717 -1.2876 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5356 -4.7531 -0.6919 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3693 3.5767 -1.9419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0435 -2.4725 1.5737 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0899 3.8430 1.4324 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8551 -0.8716 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1589 2.1205 -3.8657 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3659 -2.8540 4.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7614 2.6732 -3.9304 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9613 -3.0835 3.7086 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3120 2.0072 -2.6046 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6556 -2.1982 3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3187 2.0026 1.1048 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4498 3.2815 1.4835 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2317 -0.6500 -0.5293 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5773 2.3688 -0.5248 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1448 -1.3096 1.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6665 -0.1052 -0.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6863 -0.8119 0.7951 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4663 -0.2624 2.4063 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4099 1.4707 -1.5412 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8159 0.4493 2.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7598 2.1765 -1.2568 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9677 1.6692 0.8498 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 18 1 0 0 0 0 2 18 2 0 0 0 0 3 9 1 0 0 0 0 3 14 1 0 0 0 0 3 18 1 0 0 0 0 4 13 1 0 0 0 0 4 26 2 0 0 0 0 5 14 2 0 0 0 0 5 26 1 0 0 0 0 6 26 1 0 0 0 0 6 39 1 0 0 0 0 6 72 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 46 1 0 0 0 0 7 47 1 0 0 0 0 8 13 1 0 0 0 0 8 48 1 0 0 0 0 8 49 1 0 0 0 0 9 12 1 0 0 0 0 9 50 1 0 0 0 0 9 51 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 11 15 1 0 0 0 0 11 24 2 0 0 0 0 12 16 1 0 0 0 0 12 25 2 0 0 0 0 13 17 2 0 0 0 0 14 17 1 0 0 0 0 15 19 1 0 0 0 0 15 27 2 0 0 0 0 16 20 1 0 0 0 0 16 28 2 0 0 0 0 17 52 1 0 0 0 0 19 29 1 0 0 0 0 19 33 2 0 0 0 0 20 30 1 0 0 0 0 20 34 2 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 31 1 0 0 0 0 24 62 1 0 0 0 0 25 32 1 0 0 0 0 25 63 1 0 0 0 0 27 35 1 0 0 0 0 27 64 1 0 0 0 0 28 36 1 0 0 0 0 28 65 1 0 0 0 0 29 31 2 0 0 0 0 29 66 1 0 0 0 0 30 32 2 0 0 0 0 30 67 1 0 0 0 0 31 68 1 0 0 0 0 32 69 1 0 0 0 0 33 37 1 0 0 0 0 33 70 1 0 0 0 0 34 38 1 0 0 0 0 34 71 1 0 0 0 0 35 37 2 0 0 0 0 35 73 1 0 0 0 0 36 38 2 0 0 0 0 36 74 1 0 0 0 0 37 75 1 0 0 0 0 38 76 1 0 0 0 0 39 40 1 0 0 0 0 39 77 1 0 0 0 0 39 78 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 41 43 1 0 0 0 0 41 79 1 0 0 0 0 42 44 2 0 0 0 0 42 80 1 0 0 0 0 43 45 2 0 0 0 0 43 81 1 0 0 0 0 44 45 1 0 0 0 0 44 82 1 0 0 0 0 45 83 1 0 0 0 0 M END $$$$