70248072 -OEChem-03292408443D 69 72 0 1 0 0 0 0 0999 V2000 2.5143 -2.4926 1.8428 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0437 -3.0515 1.1270 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8076 0.8456 -0.2616 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2954 -3.8468 -2.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4160 -4.2548 -1.4143 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9725 -1.7512 -0.5508 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4245 1.3322 1.6580 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3512 -0.4954 2.4271 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1561 -1.2012 1.3374 C 0 0 2 0 0 0 0 0 0 0 0 0 0.9366 0.9098 1.9705 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1505 -0.4311 3.7357 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1758 1.6563 3.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3875 0.3175 4.8261 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3705 -1.4066 0.0237 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9696 1.7105 4.3654 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1855 -2.0557 -1.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0602 -2.1709 0.2751 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4632 -1.3235 -1.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3028 -2.3126 -0.4981 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2742 0.1200 -1.9554 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3548 -1.2843 -0.9337 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3382 -0.0320 -0.0908 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9560 1.1355 -1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4058 0.4350 -3.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4067 -3.5596 -1.3637 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1503 1.2998 -0.5558 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5040 0.0205 1.2739 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7694 2.4661 -1.6596 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2089 2.1359 0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 1.7657 -3.3751 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9009 2.7812 -2.7048 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9354 1.8758 -1.8236 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0627 3.5250 0.4734 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7874 3.2638 -1.9266 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8505 4.0737 -0.7945 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4430 -1.0684 2.6536 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0835 -0.6501 1.1565 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8228 1.4896 1.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2815 0.8660 1.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3773 -1.4388 4.1027 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1122 0.0686 3.5618 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7839 1.1576 3.2457 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0514 2.6740 2.7269 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0118 0.3985 5.7231 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4962 -0.2566 5.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0862 -0.4147 -0.3458 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3681 2.1918 5.1446 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8630 2.3306 4.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5248 -2.1693 -1.9904 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4533 -3.0824 -0.8392 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1928 -2.8621 1.2531 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2143 -1.4263 -0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8877 -1.8525 -2.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7730 -1.0729 -1.2806 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4844 -2.6390 0.5336 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2015 -1.0269 -1.9893 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3577 -1.7269 -0.8727 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8721 -0.3441 -3.5378 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6715 -0.7553 2.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2936 3.2674 -1.1458 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5434 2.0110 -4.1894 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5094 1.6633 2.6091 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7552 3.8172 -2.9965 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8819 1.2615 -2.7177 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1818 1.6739 0.0844 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4085 -4.6561 -2.6257 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1109 4.1561 1.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6207 3.7136 -2.9018 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7324 5.1494 -0.8975 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 51 1 0 0 0 0 2 17 2 0 0 0 0 3 23 1 0 0 0 0 3 65 1 0 0 0 0 4 25 1 0 0 0 0 4 66 1 0 0 0 0 5 25 2 0 0 0 0 6 17 1 0 0 0 0 6 19 1 0 0 0 0 6 54 1 0 0 0 0 7 27 1 0 0 0 0 7 29 1 0 0 0 0 7 62 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 8 36 1 0 0 0 0 9 14 1 0 0 0 0 9 37 1 0 0 0 0 10 12 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 13 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 15 1 0 0 0 0 12 42 1 0 0 0 0 12 43 1 0 0 0 0 13 15 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 46 1 0 0 0 0 15 47 1 0 0 0 0 15 48 1 0 0 0 0 16 18 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 18 20 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 21 1 0 0 0 0 19 25 1 0 0 0 0 19 55 1 0 0 0 0 20 23 1 0 0 0 0 20 24 2 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 26 1 0 0 0 0 22 27 2 0 0 0 0 23 28 2 0 0 0 0 24 30 1 0 0 0 0 24 58 1 0 0 0 0 26 29 1 0 0 0 0 26 32 2 0 0 0 0 27 59 1 0 0 0 0 28 31 1 0 0 0 0 28 60 1 0 0 0 0 29 33 2 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 63 1 0 0 0 0 32 34 1 0 0 0 0 32 64 1 0 0 0 0 33 35 1 0 0 0 0 33 67 1 0 0 0 0 34 35 2 0 0 0 0 34 68 1 0 0 0 0 35 69 1 0 0 0 0 M END > 70248072 > 1.6 > 2 136 49 87 84 12 149 170 86 129 52 166 122 187 137 193 37 10 54 92 151 164 13 154 131 36 192 186 130 16 184 68 94 201 179 14 120 191 189 8 165 67 33 197 143 43 82 65 64 90 96 160 181 141 26 198 145 119 199 180 98 117 57 19 116 112 3 44 171 159 91 157 190 108 41 142 42 100 103 63 75 45 114 185 47 111 162 78 62 30 104 126 168 60 123 155 77 56 109 178 183 139 93 182 200 28 15 21 48 73 144 124 161 121 35 175 147 24 163 101 97 150 53 125 80 153 34 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1 17904442484933832804 13642711 20 17275103977078865892 14114206 34 17129871508447048473 14251757 17 17917162675084383392 14279260 333 16519359934132099018 17921350 177 16882441745406878645 17974551 9 14638238449247542957 20764821 26 16962707618864047076 21860390 5 17096935659528293688 25019877 29 14467659643893442482 3493558 16 18413101767607168520 392239 28 16662933272927309649 469060 322 17325536496163614162 46939830 39 15314964615822787873 > 680.97 7.66 5.06 4.81 0.34 1.68 -5.83 4.62 2.76 2.21 3.44 -2.18 -2.15 -4.38 > 1451.039 > 375.5 > 2 5 10 $$$$