B9I1VO -OEChem-04012114002D 61 66 0 0 0 0 0 0 0999 V2000 5.2740 3.5330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -4.0363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -2.0363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 0.4637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -0.5363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3798 2.0052 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -2.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -3.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -3.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -5.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -1.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5298 -0.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -5.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 0.9637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 0.4637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 -0.8410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5836 0.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -6.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -5.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1719 0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2778 2.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -7.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -5.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1799 2.0122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9939 -6.5363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1381 4.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1342 5.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2663 5.5330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9983 5.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2624 6.5329 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9944 6.5396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1265 7.0363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3178 -1.9537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9192 -2.6439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8725 -2.6439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4739 -1.9537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9192 -3.4286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3178 -4.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4739 -4.1189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8725 -3.4286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7853 -4.9286 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1838 -5.6189 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -1.4303 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 1.3578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 -0.0363 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7249 -6.8463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -4.4163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7052 0.6544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7180 2.3201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 -7.6563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -5.2263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5309 -6.8463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3524 3.4545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7482 4.1463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7305 5.2209 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5364 5.2317 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7243 6.8409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5302 6.8517 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1241 7.6563 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 28 1 0 0 0 0 2 9 1 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 3 12 1 0 0 0 0 4 13 1 0 0 0 0 4 15 1 0 0 0 0 4 18 1 0 0 0 0 5 12 2 0 0 0 0 5 16 1 0 0 0 0 6 15 1 0 0 0 0 6 23 2 0 0 0 0 7 9 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 10 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 10 42 1 0 0 0 0 11 14 1 0 0 0 0 11 43 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 13 17 2 0 0 0 0 14 20 2 0 0 0 0 14 21 1 0 0 0 0 15 16 2 0 0 0 0 16 22 1 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 47 1 0 0 0 0 20 24 1 0 0 0 0 20 48 1 0 0 0 0 21 25 2 0 0 0 0 21 49 1 0 0 0 0 22 26 2 0 0 0 0 22 50 1 0 0 0 0 23 26 1 0 0 0 0 24 27 2 0 0 0 0 24 52 1 0 0 0 0 25 27 1 0 0 0 0 25 53 1 0 0 0 0 26 51 1 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 28 56 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 30 32 1 0 0 0 0 30 57 1 0 0 0 0 31 33 2 0 0 0 0 31 58 1 0 0 0 0 32 34 2 0 0 0 0 32 59 1 0 0 0 0 33 34 1 0 0 0 0 33 60 1 0 0 0 0 34 61 1 0 0 0 0 M END $$$$