BE7R4M -OEChem-04022100152D 104107 0 1 0 0 0 0 0999 V2000 11.6350 -0.4151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0010 0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0010 0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5010 3.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5010 1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2331 -1.9151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0010 -0.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0010 -0.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9030 -1.4151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0010 2.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5010 3.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0698 -3.6208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0010 0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5010 1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1002 -3.9681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2331 -2.9151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 3.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5010 -2.9151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 2.6830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5010 1.8170 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5010 1.8170 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5010 -1.9151 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5010 0.0849 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.6350 -1.4151 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.3671 -1.4151 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.3671 -0.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0010 0.9510 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0010 2.6830 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0010 2.6830 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5010 0.0849 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0010 0.9510 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.5010 0.0849 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7690 -1.9151 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.5010 1.8170 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5010 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.4510 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.1350 -0.5490 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2690 -1.0490 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.0010 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4271 -2.8548 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 -0.5490 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.0010 0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.4510 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4422 -3.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3671 -3.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3671 -4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1210 1.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8810 1.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9641 -2.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3711 -0.9901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3671 -2.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9776 -0.5227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5791 0.1675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3110 0.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 3.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3110 3.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1910 -0.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6910 0.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8110 -0.4520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7690 -1.2951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1210 1.8170 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6087 4.1596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9184 3.7611 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.1690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9641 -3.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8934 2.0724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5836 2.4710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0376 -2.7471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.1690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6910 2.1461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7700 -1.6051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6910 -1.3180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3810 -0.7811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3660 -1.7251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4422 -2.4084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8316 -2.9208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6910 3.2200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8469 1.4879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2269 0.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.6690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1910 4.0860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8577 -4.2034 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3110 1.4879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7471 -4.4151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3671 -5.0351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9871 -4.4151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5380 4.1051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3110 4.9520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4641 4.7251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4896 -4.0758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 28 2 1 6 0 0 0 32 2 1 6 0 0 0 25 3 1 1 0 0 0 36 3 1 6 0 0 0 26 4 1 6 0 0 0 41 4 1 1 0 0 0 5 34 1 0 0 0 0 5 40 1 0 0 0 0 6 36 1 0 0 0 0 6 39 1 0 0 0 0 7 41 1 0 0 0 0 7 48 1 0 0 0 0 30 8 1 6 0 0 0 8 82 1 0 0 0 0 35 9 1 6 0 0 0 9 83 1 0 0 0 0 37 10 1 1 0 0 0 10 84 1 0 0 0 0 38 11 1 1 0 0 0 11 85 1 0 0 0 0 39 12 1 6 0 0 0 12 88 1 0 0 0 0 42 13 1 1 0 0 0 13 92 1 0 0 0 0 43 14 1 6 0 0 0 14 93 1 0 0 0 0 15 44 1 0 0 0 0 15 94 1 0 0 0 0 45 16 1 6 0 0 0 16 95 1 0 0 0 0 46 17 1 6 0 0 0 17 96 1 0 0 0 0 18 47 1 0 0 0 0 18 97 1 0 0 0 0 19 47 2 0 0 0 0 20 49 1 0 0 0 0 20104 1 0 0 0 0 21 50 2 0 0 0 0 22 52 2 0 0 0 0 27 23 1 1 0 0 0 23 50 1 0 0 0 0 23 74 1 0 0 0 0 33 24 1 1 0 0 0 24 52 1 0 0 0 0 24 81 1 0 0 0 0 25 26 1 0 0 0 0 25 34 1 0 0 0 0 25 55 1 0 0 0 0 26 33 1 0 0 0 0 26 56 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 27 57 1 0 0 0 0 28 31 1 0 0 0 0 28 47 1 0 0 0 0 29 38 1 0 0 0 0 29 58 1 1 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 35 1 0 0 0 0 32 39 1 0 0 0 0 32 62 1 0 0 0 0 33 40 1 0 0 0 0 33 63 1 0 0 0 0 34 44 1 6 0 0 0 34 64 1 0 0 0 0 35 37 1 0 0 0 0 35 65 1 0 0 0 0 36 37 1 0 0 0 0 36 66 1 0 0 0 0 37 67 1 0 0 0 0 38 45 1 0 0 0 0 38 68 1 0 0 0 0 39 69 1 0 0 0 0 40 70 1 0 0 0 0 40 71 1 0 0 0 0 41 42 1 0 0 0 0 41 72 1 0 0 0 0 42 43 1 0 0 0 0 42 73 1 0 0 0 0 43 46 1 0 0 0 0 43 75 1 0 0 0 0 44 76 1 0 0 0 0 44 77 1 0 0 0 0 45 49 1 0 0 0 0 45 78 1 0 0 0 0 46 48 1 0 0 0 0 46 79 1 0 0 0 0 48 51 1 6 0 0 0 48 80 1 0 0 0 0 49 86 1 0 0 0 0 49 87 1 0 0 0 0 50 53 1 0 0 0 0 51 89 1 0 0 0 0 51 90 1 0 0 0 0 51 91 1 0 0 0 0 52 54 1 0 0 0 0 53 98 1 0 0 0 0 53 99 1 0 0 0 0 53100 1 0 0 0 0 54101 1 0 0 0 0 54102 1 0 0 0 0 54103 1 0 0 0 0 M END $$$$