56851424 -OEChem-05052417313D 50 53 0 1 0 0 0 0 0999 V2000 1.8124 -2.4591 -0.7036 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5213 1.2873 1.2556 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8767 -0.2107 0.9781 N 0 0 1 0 0 0 0 0 0 0 0 0 -1.0381 1.4712 -2.4272 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3810 -0.1993 -0.5863 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0316 2.8404 0.4635 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9912 0.7094 -0.1710 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.9218 1.8340 0.3196 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3269 1.4283 1.7296 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1157 -0.0722 1.7437 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6262 -1.5915 0.5856 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 1.2258 -0.6395 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1786 -1.8229 0.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7984 1.9054 0.2275 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2240 1.0364 -1.9453 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8277 -2.2887 -1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1882 -1.5711 1.1916 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 2.3681 -0.2315 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2399 2.1275 -1.5554 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4866 -2.5028 -1.3428 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1530 -1.7852 0.8739 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5037 -2.2511 -0.3932 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7241 -1.4830 -0.3373 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9174 -1.8663 0.2536 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8164 -0.8677 0.6119 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4991 0.4646 0.3717 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2798 0.7436 -0.2244 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4172 1.5297 0.7346 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5031 0.2137 -1.0083 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8153 1.8699 -0.3164 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4762 2.8343 0.3132 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3587 1.7089 1.9607 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6691 1.9142 2.4609 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0149 -0.4544 2.7642 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9563 -0.5794 1.2532 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2895 -1.9095 -0.2295 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8496 -2.2643 1.4256 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0772 2.0821 1.2626 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8405 0.5147 -2.6707 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5885 -2.4876 -1.7749 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4467 -1.2164 2.1859 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1085 2.8986 0.4266 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7064 2.4676 -1.9626 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2193 -2.8643 -2.3319 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9025 -1.5994 1.6385 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1492 -2.9102 0.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7569 -1.1504 1.0767 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9335 1.7426 -0.4562 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1563 3.1206 0.0395 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6573 3.6039 0.7007 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 28 2 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 4 15 1 0 0 0 0 4 19 2 0 0 0 0 5 23 2 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 6 49 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 8 31 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 13 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 12 15 2 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 14 38 1 0 0 0 0 15 39 1 0 0 0 0 16 20 1 0 0 0 0 16 40 1 0 0 0 0 17 21 2 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 43 1 0 0 0 0 20 22 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 27 48 1 0 0 0 0 M END > 56851424 > 1 > 1 93 39 244 122 54 27 245 64 219 131 68 35 59 3 74 113 194 205 183 20 177 164 208 172 33 26 4 166 43 229 152 165 115 66 23 184 221 241 155 88 92 119 137 206 79 201 174 11 77 185 2 237 99 104 132 247 145 149 38 139 69 78 173 146 250 72 120 25 128 108 84 217 133 176 124 158 134 212 140 126 70 89 19 58 251 235 96 181 105 36 144 187 118 195 112 12 209 179 10 94 102 142 6 249 207 159 40 81 138 95 243 202 156 42 199 9 239 160 82 233 63 171 16 50 5 91 193 200 45 22 150 238 73 111 191 28 252 192 204 31 100 182 56 240 178 242 220 8 218 24 211 203 29 101 246 83 225 162 30 236 14 175 48 123 117 135 228 41 129 85 7 67 46 190 163 116 224 188 154 210 215 186 136 157 55 21 161 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18408603660599547296 13583140 156 17532634755631928882 14068700 675 17556559261243378751 14341114 328 17846495902862208349 14765038 42 18272657878431117608 14840074 17 18261120702504035236 15163728 17 15121838929578473865 15840311 113 17699027102181736521 16110190 28 18261959643156529892 17349148 13 14057299544844652225 20764821 26 18127108987538526952 21302155 148 18337396049427670468 21304303 282 14998219776331601239 21623110 236 18411133658277148677 23227448 37 18413389847500203983 23559900 14 18198348342619275706 2838139 119 18341890740817816351 350125 39 18409735032922472390 3680242 22 18334582300097508000 392239 28 18411136892187010729 469060 322 17240475940071347023 5104073 3 18335707130389065987 56638632 10 18201999950063972769 6287921 2 17984436143695310615 7064713 232 18410302401648317501 > 544.56 12.24 3.36 1.61 9.84 0.24 0.42 -6.47 -7.08 0.79 0.54 -1.33 -0.38 0.75 > 1188.74 > 294.4 > 2 5 10 $$$$