NMPC 1101-Heptadecane,2,6,10,14-tetramethyl (29036)
  -OEChem-12162301313D

 65 64  0     1  0  0  0  0  0999 V2000
   -0.0635   -2.5930    1.3018 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.3567   -3.3545    0.0262 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2126   -1.2687   -1.3129 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.8647   -3.5589   -0.1809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5903   -2.3548    1.3467 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6592   -2.2478   -0.2053 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0711   -1.2485    0.4003 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9924    0.0641   -1.2449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5940   -1.0809    0.4752 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1228    0.0690   -0.4056 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.5201    1.0039   -0.1292 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3599   -3.3360    2.5741 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3844   -1.8705   -2.7128 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3177    2.3132   -0.1358 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5777    1.4336    0.0707 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8699    3.3099    0.9495 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8389   -0.1624   -1.8923 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2010    2.6585   -0.6045 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4030    3.7171    0.8015 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7577    4.5562    0.9067 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6389    3.9504   -0.0285 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4223   -1.6104    1.3165 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1111   -4.3482    0.0441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0561   -2.8607   -0.8592 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1504   -1.0292   -1.1867 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2620   -4.1942    0.6191 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0271   -4.1208   -1.1074 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1157   -3.2916    1.1220 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8827   -2.0711    2.3662 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981   -1.7656    0.7757 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7190   -2.4944   -0.3508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7786   -1.4882   -0.6261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5635   -0.3191    0.6768 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0646   -0.1403   -1.1311 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8785    0.5985   -2.1973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8914   -0.9002    1.5159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0768   -2.0181    0.1710 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2139    0.0832   -0.2801 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4541    1.2053   -0.2780 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6284    0.5202    0.8474 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0397   -2.7925    3.4697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0791   -4.3387    2.6112 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4478   -3.4366    2.6326 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4228   -2.1706   -2.8893 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7450   -2.7467   -2.8549 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1053   -1.1473   -3.4869 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2285    2.7856   -1.1227 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3809    2.0813    0.0065 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7364    1.5154    1.1539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4942    1.4790   -0.0914 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9970    2.8387    1.9324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1201   -1.1787   -2.1880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4198    0.5267   -2.5135 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7809   -0.0161   -2.1324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0046    2.6419   -1.6816 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2883    2.6436   -0.4687 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7316    2.8745    0.9915 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1432    4.5004    1.5220 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1964    4.1015   -0.2030 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8104    4.2890    1.0470 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4839    5.2572    1.7023 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6647    5.0782   -0.0518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5554    4.0068   -0.1748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0939    4.8145   -0.5227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8457    4.0249    1.0438 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1 12  1  0  0  0  0
  1 22  1  0  0  0  0
  2  4  1  0  0  0  0
  2 23  1  0  0  0  0
  2 24  1  0  0  0  0
  3  6  1  0  0  0  0
  3  8  1  0  0  0  0
  3 13  1  0  0  0  0
  3 25  1  0  0  0  0
  4  6  1  0  0  0  0
  4 26  1  0  0  0  0
  4 27  1  0  0  0  0
  5  7  1  0  0  0  0
  5 28  1  0  0  0  0
  5 29  1  0  0  0  0
  6 30  1  0  0  0  0
  6 31  1  0  0  0  0
  7  9  1  0  0  0  0
  7 32  1  0  0  0  0
  7 33  1  0  0  0  0
  8 11  1  0  0  0  0
  8 34  1  0  0  0  0
  8 35  1  0  0  0  0
  9 10  1  0  0  0  0
  9 36  1  0  0  0  0
  9 37  1  0  0  0  0
 10 15  1  0  0  0  0
 10 17  1  0  0  0  0
 10 38  1  0  0  0  0
 11 14  1  0  0  0  0
 11 39  1  0  0  0  0
 11 40  1  0  0  0  0
 12 41  1  0  0  0  0
 12 42  1  0  0  0  0
 12 43  1  0  0  0  0
 13 44  1  0  0  0  0
 13 45  1  0  0  0  0
 13 46  1  0  0  0  0
 14 16  1  0  0  0  0
 14 47  1  0  0  0  0
 14 48  1  0  0  0  0
 15 18  1  0  0  0  0
 15 49  1  0  0  0  0
 15 50  1  0  0  0  0
 16 19  1  0  0  0  0
 16 20  1  0  0  0  0
 16 51  1  0  0  0  0
 17 52  1  0  0  0  0
 17 53  1  0  0  0  0
 17 54  1  0  0  0  0
 18 21  1  0  0  0  0
 18 55  1  0  0  0  0
 18 56  1  0  0  0  0
 19 57  1  0  0  0  0
 19 58  1  0  0  0  0
 19 59  1  0  0  0  0
 20 60  1  0  0  0  0
 20 61  1  0  0  0  0
 20 62  1  0  0  0  0
 21 63  1  0  0  0  0
 21 64  1  0  0  0  0
 21 65  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
29036

> <PUBCHEM_CONFORMER_RMSD>
1.6

> <PUBCHEM_CONFORMER_DIVERSEORDER>
2
18
32
7
9
12
8
30
53
37
36
1
40
31
52
21
17
29
5
20
28
46
48
50
10
25
3
55
19
39
47
38
24
13
15
56
51
16
33
11
4
6
49
43
23
22
27
34
44
45
42
14
41
54
35
26

> <PUBCHEM_MMFF94_PARTIAL_CHARGES>
0

> <PUBCHEM_EFFECTIVE_ROTOR_COUNT>
14

> <PUBCHEM_PHARMACOPHORE_FEATURES>
5
1 12 hydrophobe
1 13 hydrophobe
1 17 hydrophobe
1 21 hydrophobe
3 16 19 20 hydrophobe

> <PUBCHEM_HEAVY_ATOM_COUNT>
21

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
3

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
1

> <PUBCHEM_CONFORMER_ID>
0000716C00000002

> <PUBCHEM_MMFF94_ENERGY>
19.8478

> <PUBCHEM_FEATURE_SELFOVERLAP>
25.376

> <PUBCHEM_SHAPE_FINGERPRINT>
12100795 323 17548419657713572720
14251764 38 18410565219160214426
14466204 15 18410288082717553818
1768 85 18339095808852948377
20398071 114 18409449202232004793
20567600 299 18338517409079119687
20621476 13 18410855417289531600
21344244 78 16816565537522114531
21860390 5 18197198287863170598
238 59 18131079280702018014
238918 7 18198902707243814956
3187 122 17106229096520124899
84936 182 18189059711305354955
9862522 239 17193203752490942856

> <PUBCHEM_SHAPE_MULTIPOLES>
432.17
8.58
7.13
1.94
6.93
5.02
0.35
8.4
2.31
-4.55
-3.15
-0.72
-1.79
2.67

> <PUBCHEM_SHAPE_SELFOVERLAP>
787.761

> <PUBCHEM_SHAPE_VOLUME>
277.7

> <PUBCHEM_COORDINATE_TYPE>
2
5
10

$$$$
