# Details of computing
0: ANISIC.cif
1: ANISIC01.cif
2: ANISIC02.cif
3: ANISIC03.cif
4: ANISIC04.cif
5: DEZYIS.cif
6: EVEMOI.cif
7: EVEXIN.cif
8: EVIHOH.cif
9: EVOKEG.cif
10: EXIBET.cif
11: KEZFOM.cif
13: KIYFEF.cif
14: KIZZUQ.cif
15: KOBBAG.cif
16: KUJNOU.cif
17: ORUDUC.cif
18: OZEWOH.cif
19: POCWOV.cif
20: SOLGEH.cif
21: SOLHAE.cif
22: SOLHUY.cif
23: TAVZOI.cif
24: TAVZOI01.cif
25: TAVZOI02.cif
26: TAVZOI03.cif
27: TAVZOI04.cif
28: TAVZOI05.cif
29: TAVZOI06.cif
30: TAWBOL.cif
31: UNUBAI.cif
32: XOJMUF.cif
33: YANHIH.cif
-------------------------------------
| | 0 | 1 | 2 | 3 | 4 | 5 | 6 | 7 | 8 | 9 | 10 | 11 | 13 | 14 | 15 | 16 | 17 | 18 | 19 | 20 | 21 | 22 | 23 | 24 | 25 | 26 | 27 | 28 | 29 | 30 | 31 | 32 | 33 |
| 0 | 0.0000 |
0.0661 |
0.0637 |
0.1232 |
0.2053 |
30.4366 |
19.5454 |
26.2222 |
18.3517 |
29.8295 |
20.8767 |
31.6426 |
28.0692 |
30.8835 |
24.2114 |
31.0168 |
30.0814 |
27.0735 |
15.8784 |
22.2910 |
20.5139 |
8.8923 |
22.6119 |
22.5155 |
22.0213 |
24.5798 |
24.5507 |
24.1700 |
24.0040 |
24.6736 |
23.5283 |
30.4549 |
26.6663 |
| 1 | 0.0661 |
0.0000 |
0.0057 |
0.0918 |
0.1817 |
30.4691 |
19.6446 |
26.2282 |
18.3075 |
29.8479 |
20.7101 |
31.6616 |
28.0611 |
31.3538 |
24.0264 |
30.1647 |
30.2466 |
26.9884 |
15.4159 |
22.3252 |
20.4117 |
9.0008 |
22.8787 |
22.7824 |
22.2858 |
24.6281 |
24.5945 |
24.2099 |
24.1501 |
24.7208 |
23.7713 |
30.3671 |
27.1038 |
| 2 | 0.0637 |
0.0057 |
0.0000 |
0.0952 |
0.1841 |
30.4514 |
19.6196 |
26.1975 |
18.2922 |
29.8225 |
20.6850 |
31.6224 |
28.0404 |
31.0759 |
24.0151 |
30.1026 |
30.2260 |
26.9740 |
15.4243 |
22.2841 |
20.4590 |
8.7671 |
22.8701 |
22.7694 |
22.2844 |
24.6166 |
24.5832 |
24.3280 |
24.1468 |
24.7098 |
23.7195 |
30.3237 |
27.0438 |
| 3 | 0.1232 |
0.0918 |
0.0952 |
0.0000 |
0.0878 |
30.4800 |
19.6967 |
26.2865 |
18.3239 |
29.7159 |
20.8412 |
31.4201 |
27.7011 |
31.3601 |
23.6716 |
30.1693 |
30.2587 |
26.8936 |
15.4584 |
22.4859 |
19.9985 |
8.8286 |
22.6779 |
22.5786 |
22.0965 |
24.5744 |
24.5384 |
24.1345 |
23.9510 |
24.6177 |
24.1520 |
30.9292 |
27.1410 |
| 4 | 0.2053 |
0.1817 |
0.1841 |
0.0878 |
0.0000 |
30.4727 |
19.8122 |
26.4115 |
18.4085 |
29.8590 |
21.4023 |
31.5337 |
27.6055 |
31.5803 |
23.4585 |
30.5526 |
30.2343 |
26.8011 |
14.8214 |
23.1558 |
19.5625 |
8.8132 |
22.4909 |
22.3934 |
21.9182 |
24.5091 |
24.4721 |
24.0600 |
23.7035 |
24.5201 |
24.8283 |
31.9438 |
28.1208 |
| 5 | 30.4366 |
30.4691 |
30.4514 |
30.4800 |
30.4727 |
0.0000 |
26.4473 |
24.8934 |
27.7370 |
21.4713 |
35.0109 |
15.8871 |
27.4104 |
35.3243 |
34.6256 |
24.2538 |
30.9304 |
30.5390 |
35.3141 |
30.0799 |
22.0875 |
32.0346 |
35.9937 |
35.6646 |
36.3212 |
38.8421 |
38.8243 |
38.7133 |
37.4042 |
38.2879 |
28.5321 |
24.7307 |
28.6442 |
| 6 | 19.5454 |
19.6446 |
19.6196 |
19.6967 |
19.8122 |
26.4473 |
0.0000 |
24.4007 |
28.1207 |
28.3155 |
23.8410 |
28.5333 |
25.8809 |
27.5190 |
27.6440 |
24.5332 |
29.1375 |
28.3846 |
26.6001 |
21.1843 |
23.1179 |
23.4168 |
26.8487 |
26.8085 |
26.5604 |
26.7823 |
26.7698 |
26.7373 |
26.7593 |
26.6174 |
1.6772 |
20.3554 |
26.3700 |
| 7 | 26.2222 |
26.2282 |
26.1975 |
26.2865 |
26.4115 |
24.8934 |
24.4007 |
0.0000 |
21.0304 |
25.6123 |
23.5337 |
17.9985 |
29.6298 |
27.1493 |
26.6381 |
20.8101 |
27.7096 |
31.5404 |
25.3093 |
26.3413 |
14.3069 |
21.6473 |
23.8602 |
23.8009 |
23.1420 |
21.9767 |
21.9324 |
21.4142 |
18.5509 |
20.6524 |
27.6441 |
23.7599 |
29.7944 |
| 8 | 18.3517 |
18.3075 |
18.2922 |
18.3239 |
18.4085 |
27.7370 |
28.1207 |
21.0304 |
0.0000 |
28.6764 |
15.9551 |
23.1019 |
29.2510 |
34.3139 |
26.1576 |
10.5072 |
30.0429 |
26.1060 |
22.4494 |
25.4038 |
15.9690 |
21.5027 |
27.7230 |
27.6431 |
27.4307 |
29.2907 |
29.2653 |
29.0316 |
29.2100 |
29.2428 |
28.3436 |
18.8105 |
29.6898 |
| 9 | 29.8295 |
29.8479 |
29.8225 |
29.7159 |
29.8590 |
21.4713 |
28.3155 |
25.6123 |
28.6764 |
0.0000 |
33.9319 |
27.2235 |
26.9263 |
30.3198 |
30.1246 |
29.8561 |
27.8959 |
33.6672 |
36.4365 |
24.1520 |
21.8295 |
30.4050 |
28.5311 |
28.5238 |
28.5959 |
29.5857 |
29.5792 |
29.6286 |
30.7721 |
29.4937 |
31.5494 |
20.9475 |
31.7067 |
| 10 | 20.8767 |
20.7101 |
20.6850 |
20.8412 |
21.4023 |
35.0109 |
23.8410 |
23.5337 |
15.9551 |
33.9319 |
0.0000 |
26.9630 |
25.0376 |
34.0917 |
24.9265 |
27.7664 |
27.9493 |
27.0306 |
12.2064 |
25.7075 |
19.8698 |
11.2451 |
23.3675 |
23.2444 |
23.4711 |
24.5095 |
24.4938 |
24.5272 |
24.4251 |
24.8450 |
29.2049 |
27.2345 |
26.2406 |
| 11 | 31.6426 |
31.6616 |
31.6224 |
31.4201 |
31.5337 |
15.8871 |
28.5333 |
17.9985 |
23.1019 |
27.2235 |
26.9630 |
0.0000 |
33.1430 |
28.2689 |
31.4886 |
24.4403 |
29.4736 |
29.1513 |
31.2666 |
24.4245 |
27.5535 |
27.8303 |
32.4961 |
32.4842 |
30.8353 |
33.2792 |
33.2681 |
33.2146 |
33.3907 |
32.5293 |
23.2401 |
27.4358 |
32.1574 |
| 13 | 28.0692 |
28.0611 |
28.0404 |
27.7011 |
27.6055 |
27.4104 |
25.8809 |
29.6298 |
29.2510 |
26.9263 |
25.0376 |
33.1430 |
0.0000 |
25.1120 |
29.5516 |
28.1434 |
21.2271 |
30.2708 |
31.4467 |
27.8093 |
25.5705 |
25.8973 |
23.8807 |
23.9076 |
23.2534 |
25.6522 |
25.6541 |
25.6075 |
26.1598 |
25.7504 |
28.2938 |
25.2392 |
28.3244 |
| 14 | 30.8835 |
31.3538 |
31.0759 |
31.3601 |
31.5803 |
35.3243 |
27.5190 |
27.1493 |
34.3139 |
30.3198 |
34.0917 |
28.2689 |
25.1120 |
0.0000 |
28.6608 |
32.7850 |
23.7708 |
31.6561 |
36.1080 |
16.5335 |
29.3329 |
31.8523 |
25.6812 |
25.7551 |
26.1837 |
29.3195 |
29.2909 |
29.2802 |
29.4909 |
29.3127 |
26.1439 |
35.6754 |
19.1128 |
| 15 | 24.2114 |
24.0264 |
24.0151 |
23.6716 |
23.4585 |
34.6256 |
27.6440 |
26.6381 |
26.1576 |
30.1246 |
24.9265 |
31.4886 |
29.5516 |
28.6608 |
0.0000 |
27.8710 |
27.7886 |
29.0640 |
26.2347 |
30.6974 |
29.8003 |
24.7774 |
24.9741 |
24.9006 |
26.3635 |
23.6740 |
23.6852 |
23.6934 |
21.7979 |
23.9684 |
26.4977 |
32.8285 |
22.8950 |
| 16 | 31.0168 |
30.1647 |
30.1026 |
30.1693 |
30.5526 |
24.2538 |
24.5332 |
20.8101 |
10.5072 |
29.8561 |
27.7664 |
24.4403 |
28.1434 |
32.7850 |
27.8710 |
0.0000 |
29.6929 |
31.0465 |
26.7090 |
20.7772 |
20.1713 |
23.6358 |
28.5923 |
28.4164 |
28.3039 |
28.4380 |
28.6578 |
28.2819 |
28.1327 |
28.5645 |
25.9748 |
12.0191 |
29.1545 |
| 17 | 30.0814 |
30.2466 |
30.2260 |
30.2587 |
30.2343 |
30.9304 |
29.1375 |
27.7096 |
30.0429 |
27.8959 |
27.9493 |
29.4736 |
21.2271 |
23.7708 |
27.7886 |
29.6929 |
0.0000 |
28.7804 |
29.7665 |
29.6394 |
18.5163 |
30.1460 |
26.5533 |
26.5140 |
26.9399 |
29.2149 |
29.2197 |
29.3165 |
30.1630 |
28.9837 |
30.0318 |
29.2753 |
25.4361 |
| 18 | 27.0735 |
26.9884 |
26.9740 |
26.8936 |
26.8011 |
30.5390 |
28.3846 |
31.5404 |
26.1060 |
33.6672 |
27.0306 |
29.1513 |
30.2708 |
31.6561 |
29.0640 |
31.0465 |
28.7804 |
0.0000 |
21.6257 |
31.0933 |
24.1599 |
26.8727 |
22.3311 |
22.2374 |
22.0546 |
28.1895 |
28.1707 |
28.2912 |
28.6027 |
28.3992 |
29.6236 |
32.3371 |
24.1985 |
| 19 | 15.8784 |
15.4159 |
15.4243 |
15.4584 |
14.8214 |
35.3141 |
26.6001 |
25.3093 |
22.4494 |
36.4365 |
12.2064 |
31.2666 |
31.4467 |
36.1080 |
26.2347 |
26.7090 |
29.7665 |
21.6257 |
0.0000 |
31.1023 |
17.9062 |
20.6360 |
26.1904 |
26.1813 |
24.2250 |
26.9223 |
26.9070 |
26.1448 |
26.6233 |
27.1756 |
31.7059 |
31.0206 |
34.8359 |
| 20 | 22.2910 |
22.3252 |
22.2841 |
22.4859 |
23.1558 |
30.0799 |
21.1843 |
26.3413 |
25.4038 |
24.1520 |
25.7075 |
24.4245 |
27.8093 |
16.5335 |
30.6974 |
20.7772 |
29.6394 |
31.0933 |
31.1023 |
0.0000 |
25.2641 |
29.9581 |
28.6825 |
28.8513 |
28.7647 |
30.2304 |
30.2111 |
30.1111 |
30.3050 |
30.4550 |
21.8015 |
23.4509 |
28.4155 |
| 21 | 20.5139 |
20.4117 |
20.4590 |
19.9985 |
19.5625 |
22.0875 |
23.1179 |
14.3069 |
15.9690 |
21.8295 |
19.8698 |
27.5535 |
25.5705 |
29.3329 |
29.8003 |
20.1713 |
18.5163 |
24.1599 |
17.9062 |
25.2641 |
0.0000 |
11.4064 |
23.5331 |
23.4958 |
23.3963 |
25.5641 |
25.5391 |
25.0969 |
24.7636 |
25.2839 |
22.8767 |
25.5809 |
24.1600 |
| 22 | 8.8923 |
9.0008 |
8.7671 |
8.8286 |
8.8132 |
32.0346 |
23.4168 |
21.6473 |
21.5027 |
30.4050 |
11.2451 |
27.8303 |
25.8973 |
31.8523 |
24.7774 |
23.6358 |
30.1460 |
26.8727 |
20.6360 |
29.9581 |
11.4064 |
0.0000 |
22.6498 |
22.5248 |
22.4833 |
24.5180 |
24.5025 |
24.2576 |
24.1421 |
24.3622 |
25.0267 |
21.8103 |
29.4717 |
| 23 | 22.6119 |
22.8787 |
22.8701 |
22.6779 |
22.4909 |
35.9937 |
26.8487 |
23.8602 |
27.7230 |
28.5311 |
23.3675 |
32.4961 |
23.8807 |
25.6812 |
24.9741 |
28.5923 |
26.5533 |
22.3311 |
26.1904 |
28.6825 |
23.5331 |
22.6498 |
0.0000 |
0.0377 |
0.0388 |
16.9727 |
16.9793 |
16.7563 |
15.6843 |
18.2074 |
28.8735 |
29.7661 |
29.3613 |
| 24 | 22.5155 |
22.7824 |
22.7694 |
22.5786 |
22.3934 |
35.6646 |
26.8085 |
23.8009 |
27.6431 |
28.5238 |
23.2444 |
32.4842 |
23.9076 |
25.7551 |
24.9006 |
28.4164 |
26.5140 |
22.2374 |
26.1813 |
28.8513 |
23.4958 |
22.5248 |
0.0377 |
0.0000 |
0.0116 |
16.9895 |
16.9960 |
16.7691 |
15.6914 |
18.2778 |
28.8482 |
29.7281 |
29.3218 |
| 25 | 22.0213 |
22.2858 |
22.2844 |
22.0965 |
21.9182 |
36.3212 |
26.5604 |
23.1420 |
27.4307 |
28.5959 |
23.4711 |
30.8353 |
23.2534 |
26.1837 |
26.3635 |
28.3039 |
26.9399 |
22.0546 |
24.2250 |
28.7647 |
23.3963 |
22.4833 |
0.0388 |
0.0116 |
0.0000 |
16.9575 |
16.9639 |
16.7468 |
15.6733 |
18.2440 |
28.8703 |
29.7029 |
29.2876 |
| 26 | 24.5798 |
24.6281 |
24.6166 |
24.5744 |
24.5091 |
38.8421 |
26.7823 |
21.9767 |
29.2907 |
29.5857 |
24.5095 |
33.2792 |
25.6522 |
29.3195 |
23.6740 |
28.4380 |
29.2149 |
28.1895 |
26.9223 |
30.2304 |
25.5641 |
24.5180 |
16.9727 |
16.9895 |
16.9575 |
0.0000 |
0.0063 |
0.0860 |
0.1358 |
0.0418 |
28.5006 |
29.0210 |
28.9105 |
| 27 | 24.5507 |
24.5945 |
24.5832 |
24.5384 |
24.4721 |
38.8243 |
26.7698 |
21.9324 |
29.2653 |
29.5792 |
24.4938 |
33.2681 |
25.6541 |
29.2909 |
23.6852 |
28.6578 |
29.2197 |
28.1707 |
26.9070 |
30.2111 |
25.5391 |
24.5025 |
16.9793 |
16.9960 |
16.9639 |
0.0063 |
0.0000 |
0.0836 |
0.1331 |
0.0398 |
28.4959 |
29.0200 |
28.9028 |
| 28 | 24.1700 |
24.2099 |
24.3280 |
24.1345 |
24.0600 |
38.7133 |
26.7373 |
21.4142 |
29.0316 |
29.6286 |
24.5272 |
33.2146 |
25.6075 |
29.2802 |
23.6934 |
28.2819 |
29.3165 |
28.2912 |
26.1448 |
30.1111 |
25.0969 |
24.2576 |
16.7563 |
16.7691 |
16.7468 |
0.0860 |
0.0836 |
0.0000 |
0.0515 |
0.0397 |
28.5124 |
29.0882 |
29.2718 |
| 29 | 24.0040 |
24.1501 |
24.1468 |
23.9510 |
23.7035 |
37.4042 |
26.7593 |
18.5509 |
29.2100 |
30.7721 |
24.4251 |
33.3907 |
26.1598 |
29.4909 |
21.7979 |
28.1327 |
30.1630 |
28.6027 |
26.6233 |
30.3050 |
24.7636 |
24.1421 |
15.6843 |
15.6914 |
15.6733 |
0.1358 |
0.1331 |
0.0515 |
0.0000 |
0.0923 |
28.5567 |
29.4290 |
29.3583 |
| 30 | 24.6736 |
24.7208 |
24.7098 |
24.6177 |
24.5201 |
38.2879 |
26.6174 |
20.6524 |
29.2428 |
29.4937 |
24.8450 |
32.5293 |
25.7504 |
29.3127 |
23.9684 |
28.5645 |
28.9837 |
28.3992 |
27.1756 |
30.4550 |
25.2839 |
24.3622 |
18.2074 |
18.2778 |
18.2440 |
0.0418 |
0.0398 |
0.0397 |
0.0923 |
0.0000 |
28.5002 |
29.0562 |
28.9607 |
| 31 | 23.5283 |
23.7713 |
23.7195 |
24.1520 |
24.8283 |
28.5321 |
1.6772 |
27.6441 |
28.3436 |
31.5494 |
29.2049 |
23.2401 |
28.2938 |
26.1439 |
26.4977 |
25.9748 |
30.0318 |
29.6236 |
31.7059 |
21.8015 |
22.8767 |
25.0267 |
28.8735 |
28.8482 |
28.8703 |
28.5006 |
28.4959 |
28.5124 |
28.5567 |
28.5002 |
0.0000 |
26.2774 |
29.4612 |
| 32 | 30.4549 |
30.3671 |
30.3237 |
30.9292 |
31.9438 |
24.7307 |
20.3554 |
23.7599 |
18.8105 |
20.9475 |
27.2345 |
27.4358 |
25.2392 |
35.6754 |
32.8285 |
12.0191 |
29.2753 |
32.3371 |
31.0206 |
23.4509 |
25.5809 |
21.8103 |
29.7661 |
29.7281 |
29.7029 |
29.0210 |
29.0200 |
29.0882 |
29.4290 |
29.0562 |
26.2774 |
0.0000 |
28.2783 |
| 33 | 26.6663 |
27.1038 |
27.0438 |
27.1410 |
28.1208 |
28.6442 |
26.3700 |
29.7944 |
29.6898 |
31.7067 |
26.2406 |
32.1574 |
28.3244 |
19.1128 |
22.8950 |
29.1545 |
25.4361 |
24.1985 |
34.8359 |
28.4155 |
24.1600 |
29.4717 |
29.3613 |
29.3218 |
29.2876 |
28.9105 |
28.9028 |
29.2718 |
29.3583 |
28.9607 |
29.4612 |
28.2783 |
0.0000 |