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Data_for_bg_prediction.csv
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Data_for_bg_prediction.csv
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REFCODE Band gap M X Bi Sb I Br Cl Temperature min Hal...Hal aver Hal...Hal Number of Hal...Hal contacts N/aver-d Hal-t1 Hal-t2 Hal-d1 Hal-d2 Hal-d3 Hal-d4 t1-t2 t1-d1 t1-d2 t1-d3 t1-d4 t2-d1 t2-d2 t2-d3 t2-d4 d1-d2 d1-d3 d1-d4 d2-d3 d2-d4 d3-d4 delta d sigma^2
0 AGODOS01 1.94 0.0 0.0 1.0 0.0 1.0 0.0 0.0 297.0 3.9932 3.9932 4.0 1.0017028949213664 2.9624 2.9624 3.2304 3.0933 3.2304 3.0933 97.801 90.625 94.803 169.534 86.839 169.534 86.839 90.625 94.803 86.278 81.729 91.836 91.836 177.509 86.278 0.0012496016948391 19.70571163636363
1 CENHEL 2.17 1.0 0.0 0.0 1.0 1.0 0.0 0.0 150.0 3.8101 4.00675 4.0 0.9983153428589256 2.8278 2.8592 3.2168 2.9883 3.2804 3.0533 94.335 89.616 94.073 172.92 88.16 174.422 88.351 92.03 93.844 87.441 84.254 90.212 89.201 176.748 88.323 0.0030631133018513 8.822112454545442
2 CENMEQ 2.13 1.0 0.0 0.0 1.0 1.0 0.0 0.0 150.0 3.8505 3.8505 1.0 0.2597065316192702 2.8385 2.8559 3.2656 3.0683 3.2761 2.9886 94.348 94.43 95.552 174.117 87.478 169.054 87.769 89.115 95.912 84.886 82.705 90.994 89.326 175.055 87.435 0.0033010703588446 16.151462181818204
3 CENMIU 2.05 0.0 0.0 1.0 0.0 1.0 0.0 0.0 150.0 3.7872 3.7872 1.0 0.2640473172792564 2.9174 2.9296 3.2783 3.1222 3.2878 3.0511 94.815 94.864 96.871 174.119 87.284 168.475 87.288 88.83 96.542 85.358 82.05 90.151 87.896 174.115 87.718 0.0022977028235326 20.528297
4 COXZUN01 2.55 0.0 1.0 1.0 0.0 0.0 1.0 0.0 160.0 3.8043 3.82565 4.0 1.0455739547527871 2.6431 2.7079 3.062 2.8846 3.1822 2.8787 93.701 87.02 93.451 169.463 90.018 176.605 89.314 95.755 91.047 87.33 83.81 92.271 91.301 176.482 85.181 0.0041654000093583 12.50575081818181
5 ENIKIV01 2.73 1.0 1.0 0.0 1.0 0.0 1.0 0.0 297.0 3.8903 3.8903 2.0 0.5140991697298409 2.563 2.563 3.2219 2.819 3.2219 2.819 94.308 87.668 90.652 175.46 89.196 175.46 89.196 87.668 90.652 86.693 90.657 93.465 93.465 179.776 86.693 0.0089428555601432 6.087154545454552
6 FAZFEV 3.4 0.0 2.0 1.0 0.0 0.0 0.0 1.0 298.0 4.5182 4.5182 0.0 0.0 2.5102 2.6006 2.9629 2.7063 2.9872 2.7335 88.962 87.101 99.624 167.799 88.893 166.859 87.558 96.824 95.573 80.756 89.489 96.88 91.374 170.995 79.885 0.0040458607479678 30.792160090909057
7 OQUBEK 2.12 0.0 0.0 1.0 0.0 1.0 0.0 0.0 293.0 4.0602 4.06825 2.0 0.4916118724267191 2.893 2.9484 3.1769 3.147 3.3832 3.0188 94.686 88.41 94.535 172.65 92.498 170.771 88.365 92.527 94.601 82.718 84.677 93.947 87.075 172.122 85.506 0.0027946187645741 14.016898090909091
8 POYGIW 1.97 0.0 0.0 1.0 0.0 1.0 0.0 0.0 138.0 4.0429 4.0429 4.0 0.9893888050656706 2.9246 2.9246 3.2768 3.0832 3.2768 3.0832 98.279 91.161 93.59 168.541 86.805 186.541 86.805 91.161 93.59 86.131 80.27 93.406 93.406 179.396 86.131 0.0021655630743679 22.75215145454546
9 QINCOI 2.15 0.0 0.0 1.0 0.0 1.0 0.0 0.0 293.0 4.4119 4.4119 0.0 0.0 2.9095 2.967 3.1894 3.1261 3.2811 3.0275 94.353 87.821 98.369 169.971 90.007 172.114 86.931 95.228 94.659 85.252 83.079 92.919 85.112 171.341 86.267 0.0017365048034133 22.40386554545456
10 RAZMEN 2.22 1.0 0.0 0.0 1.0 1.0 0.0 0.0 295.0 3.8438 3.8438 2.0 0.5203184348821479 2.8145 2.8732 3.2202 3.0066 3.3081 3.0361 93.336 90.353 95.391 174.486 89.259 175.661 89.142 91.853 92.902 88.238 84.538 89.426 86.543 174.807 88.619 0.0033132382073282 8.86161581818182
11 SEFRII 2.82 1.0 1.0 0.0 1.0 0.0 1.0 0.0 293.0 4.3354 4.3354 0.0 0.0 2.5557 2.6297 3.0105 2.7679 3.436 2.8352 92.48 87.269 88.744 157.792 85.323 178.107 95.1 80.062 95.283 83.02 100.843 86.568 112.609 168.248 74.687 0.0102655637033047 96.79533472727272
12 ZEHCUO 1.77 0.0 0.0 1.0 0.0 1.0 0.0 0.0 296.0 3.6594 4.024066666666667 3.0 0.7455144878315467 2.8922 2.909 3.3488 3.0339 3.2882 3.1567 98.423 88.627 92.467 166.962 86.237 172.215 88.18 93.3 94.023 88.222 80.04 89.709 93.595 177.585 87.272 0.0031886675463323 22.101594090909074
13 ZUCSOH 2.0 0.0 0.0 1.0 0.0 1.0 0.0 0.0 330.0 3.993 3.993 2.0 0.5008765339343851 2.9081 2.9081 3.2733 3.0937 3.2733 3.0937 92.776 90.842 95.01 173.057 88.053 173.057 88.053 90.842 95.01 85.728 86.192 91.032 91.032 175.567 85.728 0.002325705227873 9.253347090909108