BE63JC -OEChem-04022114093D 95 98 0 1 0 0 0 0 0999 V2000 3.9608 0.2127 1.7755 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1816 1.7276 -1.4739 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0815 0.3630 0.4179 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9791 -0.7103 0.5954 N 0 0 3 0 0 0 0 0 0 0 0 0 5.5151 -0.1932 -0.2556 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2957 1.3340 -0.5727 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1080 1.3017 -0.4009 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3078 2.3298 0.6427 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2707 2.3453 -1.3584 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7990 0.0920 0.3588 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0383 0.2858 1.6738 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0918 -0.5877 -0.6859 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2753 1.0289 1.4434 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4036 0.1728 -0.8708 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -2.0666 1.1106 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4002 0.0054 0.6961 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1625 -0.6789 -0.4103 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.3917 -3.0947 0.1442 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2605 -0.2067 0.3471 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0580 -2.1981 -0.2779 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2517 -4.5652 0.5874 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8638 -2.9911 -1.3265 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3442 -0.6549 1.1025 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4549 0.7418 -0.6569 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1933 0.4761 0.2126 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8207 2.5816 -1.1337 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9398 1.0096 -0.8144 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4980 1.0961 0.7101 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8936 3.6906 -0.0889 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2904 2.3280 1.5891 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1370 3.6216 0.7933 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9669 -4.7711 1.9256 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8064 -5.5431 -0.4492 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4210 -2.6833 -2.7575 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7274 -4.4921 -1.0565 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6221 -0.1543 0.8538 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7327 1.2424 -0.9055 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8164 0.7945 -0.1501 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2620 0.8874 0.3359 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5148 1.5592 -0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1293 1.5838 -1.3899 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3492 2.7798 -0.1202 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0364 1.1007 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -0.6694 2.1555 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6565 0.8462 2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4358 -0.6466 -1.6457 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3402 -1.6171 -0.4046 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0829 2.0507 1.0952 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 1.1046 2.3857 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9928 -0.3737 -1.6033 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2133 1.1696 -1.2858 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7523 -2.3246 1.2654 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2535 -2.1375 2.1064 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8479 -0.3415 -1.3947 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4529 -2.9000 -0.0476 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8948 -2.9816 -0.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0013 -2.4916 -0.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3978 -2.4974 0.7234 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1867 -4.7898 0.7265 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9260 -2.7336 -1.2334 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1491 -0.7706 0.2817 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2375 -1.3773 1.9056 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6495 1.0876 -1.2978 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4172 -0.4004 -0.4066 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6483 0.1218 1.0945 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1549 2.9170 -1.9369 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7893 2.3881 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1666 1.3267 -0.1272 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0142 0.3332 1.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9929 3.6862 0.5371 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9119 4.6562 -0.6093 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1725 2.4399 2.2321 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4331 2.1876 2.2579 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1061 4.4615 1.4984 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0297 3.7748 0.1738 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0104 -4.4419 1.8769 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9626 -5.8304 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -4.2295 2.7365 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8769 -5.3807 -0.6148 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2930 -5.4196 -1.4084 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6653 -6.5794 -0.1245 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3448 -2.8431 -2.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9436 -3.3276 -3.4729 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6480 -1.6490 -3.0325 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6859 -4.8195 -1.1462 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3272 -5.0717 -1.7662 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0754 -4.7391 -0.0479 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4365 -0.5268 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8729 1.9745 -1.6968 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1971 2.0006 -1.1306 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1358 1.1153 1.4018 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4136 -0.1950 0.2383 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1555 2.5324 1.6218 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8097 1.0924 -2.2975 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1244 3.4154 0.2837 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 27 2 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 16 1 0 0 0 0 4 10 1 0 0 0 0 4 15 1 0 0 0 0 4 19 1 0 0 0 0 5 17 1 0 0 0 0 5 27 1 0 0 0 0 5 61 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 38 1 0 0 0 0 7 39 1 0 0 0 0 7 90 1 0 0 0 0 8 40 1 0 0 0 0 8 42 1 0 0 0 0 8 93 1 0 0 0 0 9 41 1 0 0 0 0 9 42 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 43 1 0 0 0 0 11 13 1 0 0 0 0 11 44 1 0 0 0 0 11 45 1 0 0 0 0 12 14 1 0 0 0 0 12 46 1 0 0 0 0 12 47 1 0 0 0 0 13 48 1 0 0 0 0 13 49 1 0 0 0 0 14 50 1 0 0 0 0 14 51 1 0 0 0 0 15 18 1 0 0 0 0 15 52 1 0 0 0 0 15 53 1 0 0 0 0 16 17 1 0 0 0 0 17 20 1 0 0 0 0 17 54 1 0 0 0 0 18 21 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 23 2 0 0 0 0 19 24 1 0 0 0 0 20 22 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 21 59 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 22 60 1 0 0 0 0 23 36 1 0 0 0 0 23 62 1 0 0 0 0 24 37 2 0 0 0 0 24 63 1 0 0 0 0 25 28 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 29 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 28 30 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 29 31 1 0 0 0 0 29 70 1 0 0 0 0 29 71 1 0 0 0 0 30 31 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 32 76 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 33 79 1 0 0 0 0 33 80 1 0 0 0 0 33 81 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 34 84 1 0 0 0 0 35 85 1 0 0 0 0 35 86 1 0 0 0 0 35 87 1 0 0 0 0 36 38 2 0 0 0 0 36 88 1 0 0 0 0 37 38 1 0 0 0 0 37 89 1 0 0 0 0 39 40 1 0 0 0 0 39 91 1 0 0 0 0 39 92 1 0 0 0 0 40 41 2 0 0 0 0 41 94 1 0 0 0 0 42 95 1 0 0 0 0 M END $$$$