D03AHQ -OEChem-10101305022D 114118 0 1 0 0 0 0 0999 V2000 11.1972 0.5490 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.5490 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.5011 -2.3169 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 0.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3224 1.4491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 0.0490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.9510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -1.4510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.5490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0351 -3.3918 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.9510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.0490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 3.5490 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -1.4510 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9048 0.3410 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.0490 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8671 -0.9510 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2690 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8671 -0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3670 -1.8169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.0490 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.4030 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -1.4510 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3784 -1.9200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 3.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1722 -2.8985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -2.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7722 -2.7248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6340 -1.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9651 -3.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2216 -3.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -0.9510 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1972 -1.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.5490 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6835 -1.5629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4773 -2.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 0.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4652 -4.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9651 -3.3169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9652 0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 5.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9652 -5.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4651 -4.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9651 -5.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -0.9510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -1.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0275 -0.3521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 0.6567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 -0.0336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9747 -0.3404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2845 -0.7389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8796 1.4414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4810 2.1316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.3590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7924 2.1567 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1909 1.4664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 -1.7610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.8590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4776 2.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0791 3.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8637 -2.9259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8663 -2.2905 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3788 -2.8526 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0135 2.9414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 3.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1021 -4.0082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6412 -0.4140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7619 -0.6455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0938 -3.8159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6002 -0.6410 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.6690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8663 1.3885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2220 -1.1488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8880 -2.7340 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6738 -0.0586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2753 0.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 4.1690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.2390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7297 2.5240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9326 2.5240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 4.8590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0852 -4.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6551 -2.7800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -2.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 3.2390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 5.6690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2751 -5.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8451 -4.1830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.8590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6551 -5.5860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3798 0.7396 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0125 -0.2696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3513 -1.9879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1982 -1.7610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9713 -0.9140 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 47 1 0 0 0 0 2 48 1 0 0 0 0 3 24 2 0 0 0 0 4 26 2 0 0 0 0 5 31 2 0 0 0 0 6 37 2 0 0 0 0 7 43 2 0 0 0 0 8 53 2 0 0 0 0 9 60 2 0 0 0 0 10 19 1 0 0 0 0 10 24 1 0 0 0 0 10 70 1 0 0 0 0 11 20 1 0 0 0 0 11 31 1 0 0 0 0 11 71 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 76 1 0 0 0 0 13 33 1 0 0 0 0 13 35 1 0 0 0 0 13 84 1 0 0 0 0 14 29 1 0 0 0 0 14 43 1 0 0 0 0 14 85 1 0 0 0 0 15 37 1 0 0 0 0 15 44 1 0 0 0 0 15 89 1 0 0 0 0 16 36 1 0 0 0 0 16 95 1 0 0 0 0 16 96 1 0 0 0 0 42 17 1 6 0 0 0 17 60 1 0 0 0 0 17103 1 0 0 0 0 18 53 1 0 0 0 0 18110 1 0 0 0 0 18111 1 0 0 0 0 19 21 1 1 0 0 0 19 26 1 0 0 0 0 19 62 1 0 0 0 0 20 22 1 6 0 0 0 20 24 1 0 0 0 0 20 63 1 0 0 0 0 21 23 1 0 0 0 0 21 64 1 0 0 0 0 21 65 1 0 0 0 0 22 25 1 0 0 0 0 22 66 1 0 0 0 0 22 67 1 0 0 0 0 23 28 1 0 0 0 0 23 68 1 0 0 0 0 23 69 1 0 0 0 0 25 30 1 0 0 0 0 25 35 2 0 0 0 0 27 32 1 1 0 0 0 27 37 1 0 0 0 0 27 72 1 0 0 0 0 28 36 1 0 0 0 0 28 73 1 0 0 0 0 28 74 1 0 0 0 0 29 31 1 0 0 0 0 29 34 1 1 0 0 0 29 75 1 0 0 0 0 30 33 1 0 0 0 0 30 38 2 0 0 0 0 32 39 1 0 0 0 0 32 77 1 0 0 0 0 32 78 1 0 0 0 0 33 41 2 0 0 0 0 34 40 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 35 81 1 0 0 0 0 36 82 1 0 0 0 0 36 83 1 0 0 0 0 38 45 1 0 0 0 0 38 86 1 0 0 0 0 39 49 2 0 0 0 0 39 50 1 0 0 0 0 40 51 2 0 0 0 0 40 52 1 0 0 0 0 41 46 1 0 0 0 0 41 87 1 0 0 0 0 42 43 1 0 0 0 0 42 47 1 0 0 0 0 42 88 1 0 0 0 0 44 48 1 0 0 0 0 44 53 1 1 0 0 0 44 90 1 0 0 0 0 45 46 2 0 0 0 0 45 91 1 0 0 0 0 46 92 1 0 0 0 0 47 93 1 0 0 0 0 47 94 1 0 0 0 0 48 97 1 0 0 0 0 48 98 1 0 0 0 0 49 54 1 0 0 0 0 49 99 1 0 0 0 0 50 55 2 0 0 0 0 50100 1 0 0 0 0 51 56 1 0 0 0 0 51101 1 0 0 0 0 52 57 2 0 0 0 0 52102 1 0 0 0 0 54 58 2 0 0 0 0 54104 1 0 0 0 0 55 58 1 0 0 0 0 55105 1 0 0 0 0 56 59 2 0 0 0 0 56106 1 0 0 0 0 57 59 1 0 0 0 0 57107 1 0 0 0 0 58108 1 0 0 0 0 59109 1 0 0 0 0 60 61 1 0 0 0 0 61112 1 0 0 0 0 61113 1 0 0 0 0 61114 1 0 0 0 0 M END $$$$