Volume 2 Chapter 10 Search Menu SAVE FDAT

Function

SAVE FDAT is used to specify that, for all kept hits, an FDAT file is saved.

Basic QUEST Procedure

The equivalent control command in Basic QUEST is discussed under SAVE.

Remarks

FDAT is the data file used in Versions 1 and 2 of the CSDS.

It has been retained as an output option since some users may have written software to process it.

Also, it is the file format required for input to GSTAT and PLUTO.

It should be remembered that if the number of accepted hits is large then sufficient disk space must be available to accommodate the saved output file.

Graphics QUEST3D Procedure

Ex.

Select FDAT
FDAT is now surrounded by a red box.

An FDAT file will be saved for all kept hits.

A sample FDAT entry is shown below:

#AACMAL  23770912       11  9  0  0 64  2  4 13  0  0 13132100000000000000000077
  6949 22022  9576    90  9440    90333020 5 9 6 0 5 0  0 93 14P21/c     440
R=0.0920 In ATOM-table atom labels C(1) and C(2) should be interchanged
211 0121 0112 0011 0121 6110 6
C  68O  68N  68AL135
AL1    -1900  14150  16170 O1    -28350  10370  50640 O2    -11910  11690  32400
N1     26850   6590 -31250 C2    -35200  19640  37230 C1    -24930  13650  40720
C3    -22800  12590    830 C4     21120   8400  14690 C5      7230  22800  18130
C6      7850   4360 -25250 C7     43430   2930 -24360 C8     25440   5120 -46670
C9     30390  13060 -28470
 3 6 610 6 0 1 1 1 0 4 4 4

Notes

(a)

If you change your mind you can toggle off the SAVE selection.

(b)

Select SAVE

Please select individual items. (REFC, ASER, FDAT, FCON, FBIB, POSTSCRIPT,
MODEL)

Related Command

INFO

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Volume 2 Chapter 10 Search Menu SAVE MODEL .