Ketcher 09031811172D 1 1.00000 0.00000 0 135141 0 0 0 999 V2000 13.6211 -11.6141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9102 -9.9361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6211 -12.6011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4436 -11.1206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7656 -11.8444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9102 -9.0478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4765 -13.0288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2990 -11.6141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1206 -8.5543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7327 -8.5543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2990 -12.5682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4765 -14.0159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1215 -11.1206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1206 -7.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2651 -9.0149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7327 -7.5673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5552 -9.0478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1215 -13.0288 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.6540 -14.4765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3319 -14.4765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9102 -7.1066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2651 -7.1066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4097 -9.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5552 -7.1066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9770 -12.5682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8314 -14.0159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6540 -15.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4097 -10.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5543 -9.0478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3778 -6.6131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9770 -11.5812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7995 -12.9959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8314 -15.9241 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5543 -11.0219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2651 -11.0219 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6989 -9.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3778 -5.6919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2332 -7.1066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6989 -10.5283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5543 -11.9431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2651 -11.9760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8434 -9.0807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2332 -5.1984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5552 -5.1984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0557 -6.6131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2003 -8.0608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8434 -11.0219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1206 -12.4695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4097 -12.4695 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0557 -5.6919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9112 -7.1066 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9112 -5.1984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7666 -5.6919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5562 -5.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3787 -5.6590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5562 -4.2442 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.2342 -5.1655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4116 -6.6460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5447 -3.2953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0896 -5.6590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7446 -2.7757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4246 -2.8467 0.0000 R 0 0 0 0 0 0 0 0 0 0 0 0 21.9450 -5.1326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8005 -5.6261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6559 -5.1326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5113 -5.5932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5339 -6.5241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6736 -7.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6627 -7.9965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8307 -8.4982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8198 -9.4857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9595 -9.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9486 -10.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1166 -11.4597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1392 -12.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1076 -11.1535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5024 -12.7985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3319 -13.5223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6998 -5.6590 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4097 -7.6331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0209 -9.6071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6989 -12.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8434 -11.9431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -12.4366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9880 -13.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8434 -13.9172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6989 -13.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1655 -11.9431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1984 -13.9501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8434 -14.9042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5543 -13.9172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3100 -12.4366 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8245 -16.5163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9690 -16.9770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6141 -17.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9690 -17.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6141 -17.9311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7916 -18.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4037 -18.4246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1136 -18.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2582 -17.9311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4027 -18.3917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5473 -17.9311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9690 -18.8852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1136 -19.4445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2582 -16.9441 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7587 -19.3787 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.6141 -19.9052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6141 -20.8593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4695 -19.4116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3638 -15.6609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7916 -14.8713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3439 -15.6609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8383 -8.8804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9045 -7.9234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9588 -9.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8306 -9.8074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0765 -7.3853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1457 -8.8196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6437 -10.3162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9218 -10.2705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 -7.8335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3249 -9.2379 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1571 -6.3841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0366 -5.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1023 -4.9055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0111 -4.4425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2484 -6.8471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2848 -5.8316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8940 -6.4593 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3689 -7.2953 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4895 -7.7434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6464 -7.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4381 -8.7297 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8471 -21.4805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 6 0 0 1 3 1 0 0 0 1 4 1 0 0 0 1 5 1 1 0 0 6 2 1 1 0 0 3 7 1 0 0 0 4 8 1 0 0 0 6 9 1 0 0 0 6 10 1 0 0 0 7 11 1 0 0 0 7 12 1 0 0 0 8 13 1 6 0 0 9 14 1 0 0 0 9 15 1 1 0 0 10 16 1 0 0 0 10 17 1 6 0 0 11 18 1 1 0 0 12 19 1 0 0 0 12 20 1 6 0 0 14 21 1 0 0 0 14 22 1 1 0 0 23 15 1 1 0 0 16 24 1 1 0 0 18 25 1 0 0 0 19 26 1 1 0 0 19 27 1 0 0 0 23 28 1 0 0 0 23 29 1 0 0 0 30 24 1 6 0 0 25 31 2 0 0 0 25 32 1 0 0 0 27 33 1 0 0 0 28 34 1 0 0 0 28 35 1 6 0 0 29 36 1 0 0 0 30 37 1 0 0 0 30 38 1 0 0 0 34 39 1 0 0 0 34 40 1 1 0 0 35 41 1 0 0 0 36 42 1 1 0 0 37 43 1 0 0 0 37 44 1 1 0 0 38 45 1 0 0 0 38 46 1 1 0 0 39 47 1 1 0 0 41 48 1 0 0 0 41 49 2 0 0 0 43 50 1 0 0 0 45 51 1 6 0 0 50 52 1 1 0 0 8 11 1 0 0 0 16 21 1 0 0 0 36 39 1 0 0 0 45 50 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 54 56 1 6 0 0 55 57 1 0 0 0 55 58 1 1 0 0 56 59 1 0 0 0 57 60 1 0 0 0 59 61 2 0 0 0 59 62 1 0 0 0 60 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 65 66 1 0 0 0 66 67 1 0 0 0 67 68 1 0 0 0 68 69 1 0 0 0 69 70 1 0 0 0 70 71 1 0 0 0 71 72 1 0 0 0 72 73 1 0 0 0 73 74 1 0 0 0 74 75 1 0 0 0 5 76 1 0 0 0 5 77 2 0 0 0 7 78 1 1 0 0 44 79 1 0 0 0 22 80 1 0 0 0 42 81 1 0 0 0 82 40 1 1 0 0 82 83 1 0 0 0 83 84 1 0 0 0 84 85 1 0 0 0 85 86 1 0 0 0 86 87 1 0 0 0 82 87 1 0 0 0 84 88 1 1 0 0 85 89 1 1 0 0 86 90 1 1 0 0 87 91 1 6 0 0 88 92 1 0 0 0 93 26 1 6 0 0 93 94 1 0 0 0 93 95 1 0 0 0 94 96 1 0 0 0 95 97 1 0 0 0 96 98 1 0 0 0 97 99 1 6 0 0 97 98 1 0 0 0 96100 1 0 0 0 100101 1 0 0 0 101102 1 0 0 0 102103 1 0 0 0 96104 1 1 0 0 100105 1 6 0 0 101106 1 1 0 0 98107 1 1 0 0 107108 1 0 0 0 108109 1 0 0 0 108110 2 0 0 0 93111 1 1 0 0 111112 1 0 0 0 111113 2 0 0 0 114115 1 0 0 0 114116 1 0 0 0 114117 1 1 0 0 115118 1 0 0 0 116119 1 0 0 0 117120 1 0 0 0 117121 2 0 0 0 118122 1 0 0 0 119123 1 6 0 0 119122 1 0 0 0 118124 1 0 0 0 124125 1 0 0 0 125126 1 0 0 0 126127 1 0 0 0 118128 1 1 0 0 124129 1 6 0 0 125130 1 1 0 0 122131 1 1 0 0 131132 1 0 0 0 132133 1 0 0 0 132134 2 0 0 0 114 81 1 6 0 0 109135 1 0 0 0 M CHG 3 76 -1 112 -1 120 -1 M END