BY1A6I -OEChem-04012119592D 111112 0 1 0 0 0 0 0999 V2000 4.5981 -3.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.0670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -2.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -1.4330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 -2.4330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4641 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.9330 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8660 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.4330 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3301 -3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0670 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7942 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.0670 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 5.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5622 5.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 4.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -2.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -1.9581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -1.9581 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -2.3504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -3.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -1.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -3.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7101 -3.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9501 -3.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -4.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -1.4700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 -0.3961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3722 -0.3961 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 -0.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7522 -1.4700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -4.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.2570 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 1.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4220 0.0301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 1.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 1.0920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -1.8130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -5.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4607 2.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6636 2.5419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -6.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 3.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1278 -3.4080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9248 -3.4080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 1.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 2.6039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3082 0.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -0.0530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5482 0.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2382 5.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 5.8770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6182 6.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0991 6.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2522 6.4700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0252 5.6230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0252 3.8910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8722 3.6640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0991 4.5110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8554 -1.1230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -3.5530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.3130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -2.7430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15 1 1 6 0 0 0 1 67 1 0 0 0 0 2 20 2 0 0 0 0 3 25 2 0 0 0 0 4 27 2 0 0 0 0 5 34 2 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 41 2 0 0 0 0 16 8 1 6 0 0 0 8 25 1 0 0 0 0 8 60 1 0 0 0 0 9 20 1 0 0 0 0 21 9 1 1 0 0 0 9 66 1 0 0 0 0 26 10 1 6 0 0 0 10 34 1 0 0 0 0 10 77 1 0 0 0 0 11 27 1 0 0 0 0 11 40 1 0 0 0 0 11 84 1 0 0 0 0 32 12 1 1 0 0 0 12 41 1 0 0 0 0 12 90 1 0 0 0 0 13 38 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 51 2 0 0 0 0 14 52 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 53 1 0 0 0 0 16 19 1 0 0 0 0 16 54 1 0 0 0 0 17 18 1 0 0 0 0 17 55 1 0 0 0 0 17 56 1 0 0 0 0 18 20 1 0 0 0 0 18 22 1 6 0 0 0 18 57 1 0 0 0 0 19 23 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 21 24 1 0 0 0 0 21 27 1 0 0 0 0 21 61 1 0 0 0 0 22 62 1 0 0 0 0 22 63 1 0 0 0 0 22 64 1 0 0 0 0 23 30 2 0 0 0 0 23 31 1 0 0 0 0 24 28 1 0 0 0 0 24 29 1 0 0 0 0 24 65 1 0 0 0 0 25 26 1 0 0 0 0 26 33 1 0 0 0 0 26 68 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 29 72 1 0 0 0 0 29 73 1 0 0 0 0 29 74 1 0 0 0 0 30 36 1 0 0 0 0 30 75 1 0 0 0 0 31 37 2 0 0 0 0 31 76 1 0 0 0 0 32 34 1 0 0 0 0 32 35 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 35 38 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 36 39 2 0 0 0 0 36 85 1 0 0 0 0 37 39 1 0 0 0 0 37 86 1 0 0 0 0 38 87 1 0 0 0 0 38 88 1 0 0 0 0 39 89 1 0 0 0 0 40 43 1 0 0 0 0 40 91 1 0 0 0 0 40 92 1 0 0 0 0 42 46 1 0 0 0 0 42 47 1 0 0 0 0 42 48 1 0 0 0 0 43 49 2 0 0 0 0 43 50 1 0 0 0 0 44 93 1 0 0 0 0 44 94 1 0 0 0 0 44 95 1 0 0 0 0 45 96 1 0 0 0 0 45 97 1 0 0 0 0 45 98 1 0 0 0 0 46 99 1 0 0 0 0 46100 1 0 0 0 0 46101 1 0 0 0 0 47102 1 0 0 0 0 47103 1 0 0 0 0 47104 1 0 0 0 0 48105 1 0 0 0 0 48106 1 0 0 0 0 48107 1 0 0 0 0 49 51 1 0 0 0 0 49108 1 0 0 0 0 50 52 2 0 0 0 0 50109 1 0 0 0 0 51110 1 0 0 0 0 52111 1 0 0 0 0 M END $$$$