Go to:
Gentoo Home
Documentation
Forums
Lists
Bugs
Planet
Store
Wiki
Get Gentoo!
Gentoo's Bugzilla – Attachment 163479 Details for
Bug 212689
sci-chemistry/ghemical-2.10: import scrambles molecule structure
Home
|
New
–
[Ex]
|
Browse
|
Search
|
Privacy Policy
|
[?]
|
Reports
|
Requests
|
Help
|
New Account
|
Log In
[x]
|
Forgot Password
Login:
[x]
working *.gpr file generated by ghemical-2.95
ciklohex.gpr (text/plain), 1.56 KB, created by
Reinis Danne
on 2008-08-21 14:21:37 UTC
(
hide
)
Description:
working *.gpr file generated by ghemical-2.95
Filename:
MIME Type:
Creator:
Reinis Danne
Created:
2008-08-21 14:21:37 UTC
Size:
1.56 KB
patch
obsolete
>!Header gpr 111 >!Info 1 allmm 80 >!Atoms 18 >0 6 0 0 >1 6 0 0 >2 6 0 0 >3 6 0 0 >4 6 0 0 >5 6 0 0 >6 1 0 0 >7 1 0 0 >8 1 0 0 >9 1 0 0 >10 1 0 0 >11 1 0 0 >12 1 0 0 >13 1 0 0 >14 1 0 0 >15 1 0 0 >16 1 0 0 >17 1 0 0 >!Bonds 18 >0 1 S >1 2 S >2 3 S >3 4 S >0 5 S >5 4 S >0 6 S >0 7 S >1 8 S >1 9 S >2 10 S >2 11 S >3 12 S >3 13 S >4 14 S >4 15 S >5 16 S >5 17 S >!Coord >0 +0.131803348660469 +0.0674320533871651 -0.00501800421625376 >1 +0.000135864655021578 +0.147948980331421 -0.00743821775540709 >2 -0.11175574362278 +0.0642380267381668 -0.0729968398809433 >3 -0.131803095340729 -0.0674331039190292 +0.00501602329313755 >4 -0.000134970236103982 -0.14794921875 +0.0074389367364347 >5 +0.111755177378654 -0.0642368644475937 +0.0729981511831284 >6 +0.210301801562309 +0.127220809459686 +0.0437701120972633 >7 +0.163055047392845 +0.0447936691343784 -0.108103148639202 >8 +0.0149985682219267 +0.240566566586494 -0.0650409013032913 >9 -0.0289220903068781 +0.174167215824127 +0.0954401418566704 >10 -0.0845547467470169 +0.0415492504835129 -0.1772131472826 >11 -0.205601662397385 +0.121766030788422 -0.0723086819052696 >12 -0.210299551486969 -0.127221763134003 -0.0437755472958088 >13 -0.163057893514633 -0.0447970144450665 +0.108100764453411 >14 +0.0289246886968613 -0.174168512225151 -0.0954386070370674 >15 -0.0149979628622532 -0.240566328167915 +0.0650422349572182 >16 +0.0845520347356796 -0.0415451191365719 +0.177213236689568 >17 +0.205601170659065 -0.121764592826366 +0.0723135024309158 >!PartialCharges >0 +0 >1 +0 >2 +0 >3 +0 >4 +0 >5 +0 >6 +0 >7 +0 >8 +0 >9 +0 >10 +0 >11 +0 >12 +0 >13 +0 >14 +0 >15 +0 >16 +0 >17 +0 >!End
You cannot view the attachment while viewing its details because your browser does not support IFRAMEs.
View the attachment on a separate page
.
View Attachment As Raw
Actions:
View
Attachments on
bug 212689
:
163479
|
163481
|
163482
|
163487
|
163488
|
163490
|
163492
|
171373
|
171375
|
171376