PM7 Accuracy Date:Mon Feb 11 04:20:05 2019

1-butoxy-1-tert-butyldioxy-2-propanol   1400 1-Butoxy-1-tert-butyldioxy-2-propanol

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    #  Species Formula
  1390 Dimethyl dimethylmalonateC7H12O4
  1391 3,5,7,9-TetraoxyundecaneC7H16O4
  1392 12-Crown-4C8H16O4
  1393 5,8-Dihydroxy-1,4-naphthalenedioneC10H6O4
  1394 Dimethyl isophthalateC10H10O4
  1395 Dimethyl phthalateC10H10O4
  1396 1-(tert-Butyldioxy)-3-propoxy-2-propanolC10H22O4
  1397 Be(II)O4 (ACACBE02) (Geo)H14BeC10O4
  1398 Be(II)O4 (ACACBE02)H14BeC10O4
  1399 Benzal diacetateC11H12O4
  1400 1-Butoxy-1-tert-butyldioxy-2-propanol C11H24O4
  1401 1,1-Ethanediol, 2-phenyl-, diacetateC12H14O4
  1402 Benzyl diacetateC12H14O4
  1403 Be(II)O4(2-) (YAMBOD) (Geo)H8BeC12O4
  1404 Be(II)O4(2-) (YAMBOD)H8BeC12O4
  1405 1,4,9,10-AnthracenetetroneC14H6O4
  1406 1,4-Dihydroxy-9,10-anthracenedioneC14H8O4
  1407 Diphenyl oxalateC14H10O4
  1408 Dimethyl naphthalene-2,6-dicarboxylateC14H12O4
  1409 Li(I)2(Cp)2O4 (DANPOX) (Geo)C16H26Li2O4
  1410 Li(I)2(Cp)2O4 (DANPOX)C16H26Li2O4


ΔHf: -161.3 kcal/mol,     REF: NIST Chemistry WebBook, NIST Standard Reference Database, No. 69; W. G. Mallard, P. J. Linstrom, Eds., National Institute of Standards and Technology, Gaithersberg, http://webbook.nist.gov/chemistry.
  
 PM7
1-Butoxy-1-tert-butyldioxy-2-propanol
 H=-161.3 HR=NIST
  C     0.00000000 +0    0.0000000 +0    0.0000000 +0     0     0     0
  C     1.52831409 +1    0.0000000 +0    0.0000000 +0     1     0     0
  C     1.52834482 +1  111.6033475 +1    0.0000000 +0     1     2     0
  C     1.53548245 +1  111.8128112 +1  126.1063424 +1     1     2     3
  O     1.42683584 +1  110.1905163 +1  111.6740770 +1     1     2     4
  O     1.44636634 +1  106.0762713 +1   64.5287589 +1     5     1     2
  C     1.40572367 +1  105.0361577 +1 -164.7843633 +1     6     5     1
  O     1.40946171 +1  109.8588259 +1   99.4487162 +1     7     6     5
  C     1.42337839 +1  114.3816616 +1  -77.3465858 +1     8     7     6
  C     1.53070977 +1  104.2078001 +1  165.6036049 +1     9     8     7
  C     1.53163713 +1  110.2221737 +1 -176.6536787 +1    10     9     8
  C     1.52860020 +1  110.7075706 +1  179.5302847 +1    11    10     9
  C     1.55775192 +1  105.1544399 +1  111.6590755 +1     7     6     8
  C     1.52148231 +1  111.4787196 +1  -57.0657637 +1    13     7     6
  O     1.40646954 +1  107.7287536 +1 -122.1590899 +1    13     7    14
  H     1.09526042 +1  111.5623024 +1 -176.0492568 +1     2     1     3
  H     1.09877716 +1  110.7944865 +1 -119.0055347 +1     2     1    16
  H     1.09380943 +1  111.6227752 +1 -120.1706866 +1     2     1    17
  H     1.09716924 +1  111.1274492 +1  -53.8291818 +1     3     1     2
  H     1.09659844 +1  110.9434782 +1 -118.7976283 +1     3     1    19
  H     1.09344110 +1  111.7027987 +1 -120.7280281 +1     3     1    20
  H     1.09610181 +1  111.4070353 +1   58.6942931 +1     4     1     2
  H     1.09635714 +1  111.2810067 +1  119.9223326 +1     4     1    22
  H     1.09457619 +1  110.6131086 +1  120.0055805 +1     4     1    23
  H     1.10723299 +1  112.3860217 +1  124.0066147 +1     7     6    13
  H     1.10333976 +1  108.2526451 +1  119.9247709 +1     9     8    10
  H     1.10465166 +1  110.0086681 +1  119.9823409 +1     9     8    26
  H     1.10605636 +1  110.0187370 +1 -122.5102890 +1    10     9    11
  H     1.10743703 +1  109.5273186 +1 -115.4173383 +1    10     9    28
  H     1.10684252 +1  110.1342273 +1  121.7526896 +1    11    10    12
  H     1.10686470 +1  110.1442053 +1  116.5464531 +1    11    10    30
  H     1.09595418 +1  111.4610050 +1  -59.9113454 +1    12    11    10
  H     1.09596765 +1  111.4442528 +1  120.0160827 +1    12    11    32
  H     1.09538482 +1  111.2983800 +1  119.9544205 +1    12    11    33
  H     1.11319173 +1  110.3172157 +1 -111.9400896 +1    13     7    15
  H     1.09610721 +1  111.4127593 +1   67.6199511 +1    14    13     7
  H     1.09877300 +1  111.5188023 +1 -119.7379210 +1    14    13    36
  H     1.09723321 +1  110.7866488 +1 -119.7854689 +1    14    13    37
  H     0.98329483 +1  110.1970036 +1   57.8020972 +1    15    13     7