Orca 5.0.4 RELEASE 1 2 3 4 5 7s4p1d 7s4p1d 4s1p 7s6p5d1f 10s7p1d 3s2p1d 3s2p1d 2s1p 5s3p2d1f 4s3p1d 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 C C N N N C H H Ag P C C C C H C H C H H H C C C C H C H C H H H H H H 1 1 2 2 2 1 3 3 4 5 1 1 1 1 3 1 3 1 3 3 3 1 1 1 1 3 1 3 1 3 3 3 3 3 3 1 Ag ECP Def2-ECP 8 Ag 1 361.0225609999998 AuxInfo=1/0/N:1,2,18,14,16,12,13,11;29,25,27,23,24,6,22,3,5,4;9;10/E:(4,5)(6,7);(2,3)(4,5);;/CRV:1.1,2.2,3.3,4.3,5.3,6.3,7.3,8.3;1.3,2.3,3.3,4.3,5.3,7.3,8.1,9-1,10.2;;/rA:35nC2C2N1N2NCHHAgP4C3C3C3C3HC3HC3HHHC3C3C3C3HC3HC3HHHHHH/rB:s1;;s3;s4;s5;s6;s6;s1s5;s9;s2;s11;s11;s12;s12;s13;s13;s14s16;s14;s16;s18;s6;s22;s22;s23;s23;s24;s24;s25s27;s25;s27;s29;s10;s10;s10;/rC:1.4313,.768,-.5726;2.4195,.0296,-.2746;1.7691,-1.6599,.1886;.6186,-1.9073,.1531;-.4967,-1.3754,-.0988;-1.6455,-2.2651,-.0468;-1.8457,-2.696,-1.0436;-1.4302,-3.1146,.6259;-.5965,.8753,-.7173;-2.7959,1.7615,-.9966;3.8638,-.0593,-.1535;4.5018,-1.0278,.6347;4.6562,.8794,-.8393;5.8903,-1.0535,.7341;3.897,-1.7583,1.1709;6.0422,.8462,-.7377;4.1632,1.6329,-1.4565;6.6676,-.1223,.0493;6.3698,-1.8123,1.3583;6.6398,1.5826,-1.2806;7.7573,-.1481,.1281;-2.8813,-1.5538,.4343;-4.1187,-1.789,-.1707;-2.8173,-.6559,1.5072;-5.2723,-1.1516,.2887;-4.179,-2.4762,-1.0189;-3.9657,-.0119,1.9628;-1.8514,-.4591,1.9785;-5.1985,-.2591,1.3567;-6.2315,-1.35,-.1953;-3.8976,.6856,2.8012;-6.0995,.2434,1.7161;-3.1116,2.5279,-2.1481;-3.9193,.8969,-1.0108;-3.2615,2.6836,-.0263;/R:/0/N:18,29,14,16,25,27,12,13,23,24,2,1,6,11,22,9,3,4,5,10/E:(3,4)(5,6)(7,8)(9,10)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.2,12.2,14.3,15.3,16.3,17.1,18.2,20.4 Method DFT(GTOs) Exchange PBE PBE kappa parameter XKappa 0.804000 XMuePBE 0.219520 Correlation PBE PBE beta parameter CBetaPBE 0.066725 LDAOpt PW91-LDA PostSCFGGA off Hybrid DFT is turned on ScalHFX 0.250000 ScalDFX 0.750000 ScalDFC 1.000000 ScalLDAC 1.000000 Perturbative correction 0.000000 Density functional embedding theory OFF NL short-range parameter 6.900000 RI-approximation to the Coulomb term is turned on functions 1187 RIJ-COSX (HFX calculated with COS-X)) on IntName reaction-30-qcits_irc HFTyp RHF Charge 0 Mult 1 NEL 160 Dim 376 ENuc 1686.0254105088 Eh CNVDIIS on DIISMaxIt 12 DIISStart 0.200000 DIISMaxEq 5 DIISBfac 1.050 DIISMaxC 10.000 CNVTRAH auto Auto Start mean grad. ratio tolernc. 1.125000 Auto Start start iteration 20 Auto Start num. interpolation iter. 10 iterations 16 iterations Maxiter - #DIIS iter Number of Davidson start vectors 2 Converg. threshold I (grad. norm) 1.000e-05 Converg. threshold II (energy diff.) 1.000e-08 Micro threshold 0.100 Minimum threshold for Micro iter. 0.010 NR start threshold (gradient norm) 0.001 Initial trust radius 0.400 Minimum AH scaling param. (alpha) 1.000 Maximum AH scaling param. (alpha) 1000.000 Orbital update algorithm Taylor David. guess on Maximum white noise 0.010 Quad. conv. algorithm NR CNVSOSCF off CNVShift on LevelShift 0.2500 ShiftErr 0.0010 CNVZerner off CNVDamp on DampFac 0.7000 DampMax 0.9800 DampMin 0.0000 DampErr 0.1000 CNVRico off MaxIter 125 SCFMode Direct Integral package SHARK and LIBINT hybrid scheme DirectResetFreq 20 Thresh 2.500e-11 Eh TCut 2.500e-12 Eh ConvCheckMode Total+1el-Energy ConvForced 0 TolE 1.000e-08 Eh 1-El. energy change 1.000e-05 Eh TolErr 5.000e-07 Smallest eigenvalue 2.830e-04 Time for diagonalization 0.086 sec Threshold for overlap eigenvalues 1.000e-08 Number of eigenvalues below threshold 0 Time for construction of square roots 0.015 sec Total time needed 0.103 sec 0 1 PBE0 D3BJ def2-SVP def2/J RIJCOSX TightSCF defgrid3 IRC pal8 irc maxiter 600 inithess read hess_filename "reaction-30_qcits_freq.hess" DE_Init_Displ 1.0 maxcore 4000 361.0225609999998 AuxInfo=1/0/N:1,2,18,14,16,12,13,11;29,25,27,23,24,6,22,3,5,4;9;10/E:(4,5)(6,7);(2,3)(4,5);;/CRV:1.1,2.2,3.3,4.3,5.3,6.3,7.3,8.3;1.3,2.3,3.3,4.3,5.3,7.3,8.1,9-1,10.2;;/rA:35nC2C2N1N2NCHHAgP4C3C3C3C3HC3HC3HHHC3C3C3C3HC3HC3HHHHHH/rB:s1;;s3;s4;s5;s6;s6;s1s5;s9;s2;s11;s11;s12;s12;s13;s13;s14s16;s14;s16;s18;s6;s22;s22;s23;s23;s24;s24;s25s27;s25;s27;s29;s10;s10;s10;/rC:1.4313,.768,-.5726;2.4195,.0296,-.2746;1.7691,-1.6599,.1886;.6186,-1.9073,.1531;-.4967,-1.3754,-.0988;-1.6455,-2.2651,-.0468;-1.8457,-2.696,-1.0436;-1.4302,-3.1146,.6259;-.5965,.8753,-.7173;-2.7959,1.7615,-.9966;3.8638,-.0593,-.1535;4.5018,-1.0278,.6347;4.6562,.8794,-.8393;5.8903,-1.0535,.7341;3.897,-1.7583,1.1709;6.0422,.8462,-.7377;4.1632,1.6329,-1.4565;6.6676,-.1223,.0493;6.3698,-1.8123,1.3583;6.6398,1.5826,-1.2806;7.7573,-.1481,.1281;-2.8813,-1.5538,.4343;-4.1187,-1.789,-.1707;-2.8173,-.6559,1.5072;-5.2723,-1.1516,.2887;-4.179,-2.4762,-1.0189;-3.9657,-.0119,1.9628;-1.8514,-.4591,1.9785;-5.1985,-.2591,1.3567;-6.2315,-1.35,-.1953;-3.8976,.6856,2.8012;-6.0995,.2434,1.7161;-3.1116,2.5279,-2.1481;-3.9193,.8969,-1.0108;-3.2615,2.6836,-.0263;/R:/0/N:18,29,14,16,25,27,12,13,23,24,2,1,6,11,22,9,3,4,5,10/E:(3,4)(5,6)(7,8)(9,10)/CRV:1.3,2.3,3.3,4.3,5.3,6.3,7.3,8.3,9.3,10.3,11.2,12.2,14.3,15.3,16.3,17.1,18.2,20.4 -1231.39600021 1686.02541051 -2917.42141072 -5091.87158076 2174.45017004 -2363.38292724 1131.98692703 2.08781822 80.000001221835 80.000001221835 160.000002443670 -103.540505367794 -5.616465127628 -109.156970495422 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 2.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 -2102.0977 -394.4155 -392.9507 -392.5948 -279.7077 -279.2532 -279.1513 -279.1336 -279.1056 -279.0968 -279.0415 -278.7080 -278.3597 -278.2651 -278.2539 -278.2412 -278.2358 -278.1563 -278.0556 -181.2709 -130.6507 -130.6446 -130.5949 -103.0001 -64.4701 -64.2242 -64.1800 -30.3304 -25.9057 -24.3606 -23.5601 -21.9892 -21.3639 -21.2130 -20.3526 -19.7478 -19.5423 -19.1433 -17.4088 -16.9177 -16.7194 -16.5109 -15.3986 -14.9294 -14.7438 -14.1058 -13.7005 -13.3561 -13.0340 -12.9544 -12.7873 -12.2919 -12.2376 -12.1610 -12.0006 -11.9187 -11.7669 -11.5950 -11.4390 -11.1969 -10.6112 -10.3059 -10.2233 -10.1168 -10.0752 -9.9028 -9.7585 -9.6264 -9.3683 -9.3143 -8.6689 -8.5926 -8.1655 -7.7827 -7.6003 -6.9302 -6.8013 -6.6131 -6.4169 -5.9880 -1.3306 -0.9368 -0.6534 -0.4685 0.0965 0.2444 0.3047 0.3721 0.6343 1.2870 1.6533 1.9433 2.0760 2.4645 2.6057 2.7508 3.1413 3.1714 3.3111 3.5349 3.6364 3.9476 4.0758 4.2045 4.4134 4.5147 4.9191 5.0791 5.2015 5.4315 5.8640 6.3452 7.4687 7.5564 7.7718 7.9066 8.0983 8.2740 8.3290 8.4639 8.6639 8.8430 9.0311 9.1261 9.2666 9.4514 9.6558 10.2951 10.6079 10.9019 11.3364 11.4735 11.5523 11.8356 11.8916 12.0366 12.1171 12.1909 12.5821 12.9480 13.0248 13.2841 13.3134 13.5413 13.5723 13.6917 13.8277 14.1698 14.2054 14.3181 14.5198 14.5747 14.9333 15.4137 15.4382 15.7972 16.0055 16.0988 16.2286 16.3851 16.4462 16.8189 16.9333 17.0554 17.3458 17.4816 17.5652 17.6689 17.8415 18.1155 18.3194 18.4066 18.4724 18.6529 18.8312 18.9449 19.0386 19.2609 19.3725 19.5792 19.7165 19.9577 20.0449 20.1439 20.2432 20.2999 20.4408 20.5074 20.8215 20.9020 21.1782 21.4827 21.9143 21.9908 22.2126 22.4533 22.7212 23.2794 23.3483 23.4745 23.7557 24.0155 24.6303 24.9723 25.2050 25.7871 26.0233 26.1445 26.5121 27.1394 27.3060 27.5757 28.2262 28.4058 29.2316 29.7311 29.9624 30.3400 30.7302 31.2102 31.7379 32.3080 32.6136 32.9016 33.5192 33.7773 34.1216 34.2306 34.5632 34.6369 34.8841 34.9685 35.2479 35.4674 35.6491 35.8627 36.2668 36.5683 37.1127 37.2993 37.8983 38.4800 39.8381 40.2328 41.3902 41.5727 41.9974 42.1778 43.6604 44.2033 45.0474 45.1382 45.4782 45.6413 45.9060 46.0288 46.0796 46.1510 46.7365 47.0228 47.1267 47.4022 47.5115 47.8370 47.8619 47.9252 48.0113 48.3093 48.4270 48.4570 48.4942 48.8226 48.9868 49.1528 49.4508 49.7185 50.3348 50.7657 50.9451 51.1214 51.6937 52.2143 52.4431 52.6049 53.0108 53.1832 53.5201 53.9227 54.0446 54.1427 54.6618 54.7333 54.8270 55.0663 55.4686 56.1338 56.6597 57.0980 57.1500 57.5296 57.8892 58.2445 58.8803 59.1262 59.1853 59.5489 59.8624 60.4282 60.4471 61.0363 61.5114 61.8231 61.8474 62.5353 62.5821 62.6761 63.3754 63.5664 63.5902 63.9620 64.0288 64.3921 64.5843 64.7428 65.8603 66.3899 67.1023 67.5500 68.3804 68.7675 69.1401 69.8550 70.2677 70.7533 70.9193 70.9664 71.0248 71.1722 71.2993 71.3950 71.9751 72.0831 72.3374 72.7183 72.8839 73.3005 73.8204 74.2637 74.4378 74.7733 75.0562 75.3269 76.9370 77.4081 77.9203 78.3711 78.5498 79.2357 79.4448 79.8867 80.7829 81.5021 83.0706 83.7923 84.7485 85.3014 85.9501 86.3559 86.8681 88.5539 90.5603 94.5947 98.8730 100.1826 100.9130 1470.0179 0.0000000 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 C C N N N C H H Ag P C C C C H C H C H H H C C C C H C H C H H H H H H -0.204247 0.008996 -0.153703 0.124057 -0.351746 0.266823 0.037156 0.057901 0.108281 0.056790 -0.000166 0.000957 -0.014163 -0.014853 0.022366 -0.023472 0.020069 -0.014909 0.015702 0.016377 0.016425 -0.138080 -0.034601 -0.033078 -0.025494 0.015278 -0.030143 0.045417 -0.022187 0.026762 0.029965 0.027762 0.044939 0.065394 0.053424 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 C C N N N C H H Ag P C C C C H C H C H H H C C C C H C H C H H H H H H -0.073846 -0.065509 -0.052457 0.115836 -0.098202 0.034332 0.030148 0.040737 -0.393786 0.528831 -0.032649 -0.016475 -0.010872 -0.035561 0.033046 -0.036987 0.038427 -0.037377 0.032250 0.032727 0.031169 -0.037265 -0.034117 -0.018993 -0.035004 0.034131 -0.033260 0.049047 -0.039939 0.036437 0.037412 0.035739 -0.024677 -0.016188 -0.017106 0 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 C C N N N C H H Ag P C C C C H C H C H H H C C C C H C H C H H H H H H 6.2042 5.9910 7.1537 6.8759 7.3517 5.7332 0.9628 0.9421 18.8917 14.9432 6.0002 5.9990 6.0142 6.0149 0.9776 6.0235 0.9799 6.0149 0.9843 0.9836 0.9836 6.1381 6.0346 6.0331 6.0255 0.9847 6.0301 0.9546 6.0222 0.9732 0.9700 0.9722 0.9551 0.9346 0.9466 6.0000 6.0000 7.0000 7.0000 7.0000 6.0000 1.0000 1.0000 19.0000 15.0000 6.0000 6.0000 6.0000 6.0000 1.0000 6.0000 1.0000 6.0000 1.0000 1.0000 1.0000 6.0000 6.0000 6.0000 6.0000 1.0000 6.0000 1.0000 6.0000 1.0000 1.0000 1.0000 1.0000 1.0000 1.0000 -0.2042 0.0090 -0.1537 0.1241 -0.3517 0.2668 0.0372 0.0579 0.1083 0.0568 -0.0002 0.0010 -0.0142 -0.0149 0.0224 -0.0235 0.0201 -0.0149 0.0157 0.0164 0.0164 -0.1381 -0.0346 -0.0331 -0.0255 0.0153 -0.0301 0.0454 -0.0222 0.0268 0.0300 0.0278 0.0449 0.0654 0.0534 3.5543 3.9194 2.9248 3.4824 2.9910 3.8070 0.9883 0.9968 1.9365 3.5215 3.8781 3.8428 3.8775 3.8426 1.0117 3.8503 0.9913 3.8375 0.9811 0.9809 0.9809 3.9329 3.8750 3.8578 3.8520 0.9925 3.8449 0.9978 3.8312 0.9812 0.9811 0.9814 0.9696 0.9829 0.9747 3.5543 3.9194 2.9248 3.4824 2.9910 3.8070 0.9883 0.9968 1.9365 3.5215 3.8781 3.8428 3.8775 3.8426 1.0117 3.8503 0.9913 3.8375 0.9811 0.9809 0.9809 3.9329 3.8750 3.8578 3.8520 0.9925 3.8449 0.9978 3.8312 0.9812 0.9811 0.9814 0.9696 0.9829 0.9747 0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 -0.0000 -0.0000 0.0000 0.0000 -0.0000 0.0000 -0.0000 -0.0000 -0.0000 -0.0000 -0.0000 0.0000 0.0000 0.0000 -0.0000 0.0000 0.0000 0.0000 0.0000 2.2951 0.1246 0.1063 0.8123 0.4548 0.1074 1.0275 1.9122 0.3029 1.3399 0.9482 0.2848 0.9320 0.9224 1.0104 0.5864 0.9541 0.9424 0.9574 1.3681 1.3790 1.3832 0.9756 1.4025 0.9895 1.3908 0.9828 1.3756 0.9834 0.9858 1.4075 1.3794 1.3777 0.9847 1.3907 0.9828 1.3898 0.9852 1.3770 0.9881 0.9880 0 1 0 2 0 3 0 8 1 2 1 8 1 10 2 3 2 4 3 4 4 5 4 8 5 6 5 7 5 21 8 9 9 32 9 33 9 34 10 11 10 12 11 13 11 14 12 15 12 16 13 17 13 18 15 17 15 19 17 20 21 22 21 23 22 24 22 25 23 26 23 27 24 28 24 29 26 28 26 30 28 31 -0.045953058 -1231.441953266066 32.94612 -35.66306 -2.71694 -64.47584 64.79545 0.31962 42.23448 -42.36128 -0.12680 2.73861 6.96100