L79HFD -OEChem-05022321362D 75 80 0 0 0 0 0 0 0999 V2000 14.1996 1.7483 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 19.0515 -0.9697 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.5811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4937 -0.1260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2258 0.8740 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6277 1.3740 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9578 -0.1260 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5559 -0.6260 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.5021 -1.9308 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8128 0.6292 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5333 0.1650 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5348 3.1260 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.0811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0918 1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2258 -0.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3689 2.3399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6618 1.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9578 0.8740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0918 -0.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3598 1.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4937 0.8740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8239 -0.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6899 -0.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8239 -1.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5559 -1.6260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6899 -2.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5021 -0.3213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0857 -1.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6899 -3.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0857 -1.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1449 1.3735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7913 0.8355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5857 -1.9920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4002 0.6635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1940 1.6420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3130 0.2552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1230 0.8416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4158 -0.7395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8644 2.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0359 0.4333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3287 -1.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1387 -0.5614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4839 2.6958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4903 1.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6933 1.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6152 -0.0184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0137 -0.7086 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9678 2.5004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2084 2.9388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0629 0.9547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8222 0.5163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5684 0.7663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1699 1.4566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6933 -1.1010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4903 -1.1010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7583 1.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9612 1.8489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6899 0.4940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2869 -1.9360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2711 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0699 -3.1260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6899 -3.7460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3099 -3.1260 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6683 -0.9140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9781 -0.5154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6064 1.7876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7309 1.8350 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6835 0.9595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0488 -2.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8957 -2.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1227 -1.6820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0593 1.4583 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9136 -1.1030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.5381 0.7968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.3924 -1.7645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 32 1 0 0 0 0 1 35 1 0 0 0 0 2 42 1 0 0 0 0 3 13 1 0 0 0 0 3 60 1 0 0 0 0 4 21 2 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 20 1 0 0 0 0 6 16 1 0 0 0 0 6 17 1 0 0 0 0 6 21 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 7 22 1 0 0 0 0 8 23 1 0 0 0 0 8 25 1 0 0 0 0 8 27 1 0 0 0 0 9 25 2 0 0 0 0 9 28 1 0 0 0 0 10 27 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 32 2 0 0 0 0 11 34 1 0 0 0 0 12 39 3 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 13 43 1 0 0 0 0 14 18 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 19 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 54 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 58 1 0 0 0 0 24 26 2 0 0 0 0 24 59 1 0 0 0 0 25 26 1 0 0 0 0 26 29 1 0 0 0 0 27 28 2 0 0 0 0 28 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 33 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 31 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 33 69 1 0 0 0 0 33 70 1 0 0 0 0 33 71 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 35 39 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 37 40 1 0 0 0 0 37 72 1 0 0 0 0 38 41 2 0 0 0 0 38 73 1 0 0 0 0 40 42 2 0 0 0 0 40 74 1 0 0 0 0 41 42 1 0 0 0 0 41 75 1 0 0 0 0 M END $$$$