new.book

LastWave

</molecule>
<molecule> 1 1
<atom> gauss 1024 13056 1446.75 -0.106391 743.941 3068.89 2.81141e-08 1.28402e-08 1.99431e+07 0.786001 0.618225 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 3584 5252.16 -0.0123764 -2004.83 -2356.72 6.58236e-08 -6.89163e-09 1.9147e+07 -0.41955 0.907732 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 14336 5545.08 -0.001311 2774.23 1471.83 -1.28965e-07 -1.42606e-09 1.97252e+07 0.970406 0.241478 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 32 24 9298.76 -155.766 -2673.82 1995.77 -7.6469e-07 1.46316e-07 2.22648e+07 0.315136 0.949047 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 256 14336 1831.35 -0.197971 933.808 2913.65 8.31419e-08 -2.21726e-08 1.87227e+07 0.807837 0.589406 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 25088 2935.9 -0.049734 -2339.54 2057.37 1.27173e-08 -2.73308e-08 1.94124e+07 0.352887 0.935666 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 2048 1505.09 0.00797072 -724.952 2918.66 -1.59411e-09 3.12028e-09 1.80883e+07 0.61601 0.787738 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 17536 658.652 0.0943944 1373.88 -2700.06 4.98806e-08 4.52172e-08 1.83558e+07 -0.852496 0.522734 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 1536 393.396 -0.0533984 16.0809 -3208.54 1.33773e-07 1.36619e-07 2.059e+07 -0.708877 0.705332 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 13824 15946.2 -0.0654348 2045.62 -2332.41 -1.99446e-07 1.05381e-08 1.92494e+07 -0.91087 0.412694 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 19712 759.484 -0.0634316 -1180.37 -2798.81 -8.38197e-09 1.99209e-07 1.84533e+07 -0.552903 0.833246 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 15616 2199.26 1.71912 1440.28 -2817.13 8.37254e-09 -8.51781e-08 2.00213e+07 -0.852998 0.521914 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 5120 2745.92 0.227776 -2419.11 1931.24 2.12034e-08 7.57087e-08 1.91636e+07 0.330526 0.943797 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 9216 2275.5 -0.842364 2534.92 -1693.93 -5.37125e-08 -1.28028e-07 1.85905e+07 -0.956935 0.290303 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 8192 2288.26 -1.39686 -926.557 3063.54 7.76006e-08 6.93691e-08 2.04875e+07 0.59603 0.802962 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 17920 1782.78 -0.0108603 -2433.18 -1793.85 -1.04433e-08 3.4338e-08 1.82765e+07 -0.312332 0.949973 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 14080 2666.6 -0.0621884 977 2906.59 -1.03067e-08 4.11786e-08 1.88056e+07 0.811978 0.583688 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 64 21456 1633.79 -10.7565 3004.44 587.282 0.134595 0.0171114 1.68368e+07 0.991012 0.133773 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 18944 12124.8 0.0746104 -1393.45 -2789.31 -2.04769e-07 -6.52034e-08 1.94439e+07 -0.525875 0.850562 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 19072 3572.4 -0.39281 2915.99 616.583 8.52172e-08 4.37457e-08 1.77663e+07 0.994577 0.104001 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 26624 7659.04 0.0265548 -451.428 -3011.17 6.74979e-08 4.07391e-09 1.85419e+07 -0.652586 0.757715 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 22528 480.24 -0.0888844 -3122.22 -265.387 1.94751e-08 3.95913e-08 1.96374e+07 -0.0423862 0.999101 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 26048 11348 -2.2711 -241.378 3400.19 2.10564e-09 -2.009e-07 2.3239e+07 0.681615 0.731711 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 7680 2747.58 0.063576 -870.966 2796.91 1.2829e-08 -3.63891e-08 1.71626e+07 0.59274 0.805394 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 18944 8345 0.103332 744.379 2834.1 -3.34939e-08 1.15733e-08 1.71725e+07 0.791843 0.610725 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 24576 14913.7 0.122334 2910.08 162.473 -7.30126e-08 -3.608e-09 1.69899e+07 0.999611 0.0278829 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 15872 11103 -0.0098008 -1804.62 -2260.02 3.28469e-09 1.01813e-08 1.67286e+07 -0.433597 0.901107 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 22784 2808.2 -0.0263406 -2886.1 344.82 2.86145e-08 3.15462e-08 1.68969e+07 0.0594227 0.998233 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 32 19360 3742.6 0 2068.79 2048.14 0.0715901 0 1.70246e+07 0.910647 0.413186 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 9984 15425.7 -0.102041 2827.69 -596.914 -9.03405e-08 -3.68265e-09 1.67043e+07 -0.994595 0.103831 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 25088 2770.98 0.000619316 2690.13 -1385.94 -2.83507e-08 -2.04479e-09 1.83153e+07 -0.971842 0.235632 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 26624 3737.76 0.0401812 -2366.66 1674.06 -4.67546e-09 1.18126e-08 1.68071e+07 0.302987 0.952995 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 23680 15483.6 -1.0617 279.968 2941.57 -7.28471e-08 4.92107e-08 1.74624e+07 0.739847 0.672775 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 12800 6993 -0.016702 2055.45 2190.91 1.14119e-09 3.43435e-09 1.80499e+07 0.917661 0.397364 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 10496 9361.4 0.0303322 -2780.67 835.28 -4.23671e-08 1.31692e-08 1.68596e+07 0.145385 0.989375 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 23296 2951.62 -0.091474 -2578.67 -1261.85 6.72295e-08 -2.60992e-08 1.64836e+07 -0.225587 0.974223 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 256 128 1895.98 -0.401344 -1410.57 -2610.12 2.46219e-07 -1.94341e-07 1.76049e+07 -0.512137 0.858904 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 256 17920 3043.22 3.02052 -1392.51 -2524.35 -5.42122e-08 2.00449e-07 1.66229e+07 -0.508425 0.861106 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 10752 1738.24 -0.000641772 -2312.04 1729.96 2.79016e-08 -4.04954e-09 1.66766e+07 0.31569 0.948862 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 13312 2072.28 1.35908 2639.05 1339.18 -3.71503e-09 6.2404e-08 1.7516e+07 0.972562 0.232642 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 9984 5253.12 -0.0367032 2796.6 -70.6543 -5.08589e-08 1.08416e-09 1.56519e+07 -0.99992 0.0126288 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 19968 2169.16 -0.511548 2251.02 2146.8 -3.07454e-08 2.46961e-08 1.93517e+07 0.928348 0.371712 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 5888 15733.3 0.0328908 1974.09 1951.78 -7.57583e-09 -6.62143e-09 1.54129e+07 0.924964 0.380055 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 128 13872 1596.07 0 -1016.21 2747.64 0.000465035 0 1.71704e+07 0.571577 0.820549 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 256 20800 5851.68 0.743408 997.661 -2597.54 -7.3326e-08 -1.05319e-07 1.54851e+07 -0.824181 0.566327 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 22528 3463.62 -0.00773256 2108.22 1811.26 6.11461e-08 -1.96525e-08 1.54505e+07 0.937685 0.347487 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 128 12288 2274.94 0.741304 2785.31 259.546 5.98935e-07 8.53917e-08 1.56506e+07 0.998921 0.0464412 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 24064 8385 -0.0141194 1483.59 2318.44 8.96629e-08 -1.25199e-08 1.51525e+07 0.877212 0.480104 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 768 8958.64 -0.261238 -843.467 2600.15 9.10633e-08 2.89199e-08 1.49444e+07 0.587978 0.808877 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 7424 16047.3 -0.172491 1315.02 2420.55 -2.40066e-07 1.28884e-08 1.51767e+07 0.85947 0.511187 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 1024 1382.84 0.0087078 1922.29 -1930.57 3.05385e-08 3.53033e-08 1.48445e+07 -0.923468 0.383676 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 6912 8347.76 -0.0701308 2192.36 -1805.54 -6.53648e-08 -4.13991e-09 1.61329e+07 -0.941253 0.337703 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 25728 24111.8 -0.77536 2811.94 -228.914 -2.40988e-08 2.44128e-07 1.59188e+07 -0.999175 0.0406034 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 5632 2300.22 -0.243792 -2481.74 -1188.94 5.85591e-08 -2.79678e-08 1.51452e+07 -0.221533 0.975153 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 12480 1623.82 1.69507 1749.41 2148.46 -2.33983e-08 1.35057e-07 1.53527e+07 0.903166 0.429292 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 18816 796.92 -1.27863 2040.19 -1965.26 -1.61684e-07 -2.03418e-07 1.60492e+07 -0.927419 0.374023 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 10752 3480.92 0.0039222 -169.048 -2668.29 2.18657e-08 -7.90379e-09 1.42967e+07 -0.684387 0.729119 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 16384 2326.02 -0.0525656 1432.67 -2436.56 -4.10755e-08 -2.69199e-08 1.59787e+07 -0.868002 0.496561 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 4032 741.972 0.153524 -185.006 -2644.66 -1.94703e-07 -2.99539e-07 1.40569e+07 -0.681987 0.731364 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 13056 2663.72 0.0552336 1025.85 -2560.09 2.46194e-09 -2.4148e-08 1.52128e+07 -0.828237 0.560378 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 21760 2922.26 -0.110702 1769.24 -2069.15 -4.55384e-08 1.77899e-08 1.48232e+07 -0.908262 0.418403 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 17920 5660.64 0.234234 484.578 -2749.71 1.74393e-08 -1.82269e-08 1.55914e+07 -0.766017 0.642821 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 64 288 1750.54 0 1187.66 2176.29 0.0995153 0 1.30851e+07 0.839059 0.54404 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 26048 15180 -0.725292 2535.81 -813.283 -6.38741e-08 -1.60109e-07 1.41836e+07 -0.987984 0.154554 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 384 8172.08 0.215066 -2576.55 417.593 -7.93856e-08 -5.71257e-08 1.3626e+07 0.0802504 0.996775 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 16384 16171.6 0.165901 2372.77 -1170.88 1.06247e-08 -7.2347e-08 1.4002e+07 -0.973848 0.227203 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 21760 487.92 -0.056684 -2661.77 45.5353 1.24554e-08 5.1812e-08 1.41742e+07 0.0085513 0.999963 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 27136 20705.2 0.0226606 2017.74 -1789.9 -2.6624e-07 8.84834e-10 1.455e+07 -0.934901 0.354909 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 256 3648 2623.94 -0.61546 -2641.96 -105.044 6.27661e-08 -1.69116e-07 1.3982e+07 -0.0198725 0.999803 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 10752 16023.4 0.0313402 -159.611 -2654.24 5.66314e-08 8.54698e-09 1.41409e+07 -0.685559 0.728017 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 23552 480.996 -0.01714 -250.205 -2573.65 -1.12859e-08 2.09215e-08 1.33725e+07 -0.672027 0.740527 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 16896 6017.76 0.0018094 2042.83 -1563.2 7.75718e-07 -1.10956e-11 1.32335e+07 -0.947145 0.320807 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 19968 11112.9 0.0547496 -383.654 2617.75 1.39749e-08 -3.93802e-08 1.39996e+07 0.653833 0.756639 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 22016 1739.19 -0.0471464 2489.78 -1163.24 1.41732e-08 3.04595e-08 1.51042e+07 -0.976216 0.2168 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 23808 24088 -0.0328742 2634.47 -507.518 7.94073e-07 -3.3603e-08 1.4396e+07 -0.995476 0.095009 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 256 24832 11481.2 1.01081 -2081.96 1534.03 1.54885e-07 -5.21613e-08 1.33756e+07 0.3122 0.950016 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 15872 15631.9 -0.83388 2611.02 125.743 -4.08039e-07 6.96126e-08 1.36665e+07 0.999711 0.0240587 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 17408 983.116 0.444572 989.531 2594.79 3.52884e-08 -1.50388e-07 1.54242e+07 0.823506 0.567308 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 7936 2952.08 -0.121727 -713.591 2490.35 3.37852e-08 -1.21508e-08 1.34222e+07 0.601891 0.798578 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 19968 3505.8 0.0441876 -1731.94 -2113.95 3.28925e-08 -1.32499e-10 1.49368e+07 -0.427933 0.903811 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 24064 15555 -0.926384 2359.78 1614.92 1.49054e-08 1.06198e-08 1.63531e+07 0.955315 0.29559 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 26624 23015.4 4.73168 -665.042 3287.61 7.07359e-08 5.66986e-08 2.25014e+07 0.633139 0.774038 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 896 8478.52 0.261084 2467.73 731.087 7.20229e-08 3.55419e-08 1.32484e+07 0.989648 0.143513 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 5376 14473.4 -0.0842328 -2506.2 -403.606 -1.15831e-08 -2.53706e-08 1.28878e+07 -0.0797495 0.996815 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 1024 25088 4104.28 0.128832 -996.158 -2370.15 8.6876e-08 4.58559e-08 1.32199e+07 -0.553416 0.832905 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 512 24192 11461.6 -0.100031 -723.876 2548.77 -6.84916e-08 -7.21047e-09 1.40405e+07 0.602824 0.797874 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 16384 19455.1 -0.0266238 -2423.36 783.924 -5.8021e-07 6.69623e-08 1.29745e+07 0.155795 0.987789 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 27136 2770.46 -0.0211526 -1302.06 -2299.51 2.05932e-08 -4.13444e-10 1.39663e+07 -0.503623 0.863923 </atom>
</molecule>
<molecule> 1 1
<atom> gauss 2048 15872 8