From 5736776d736bf6d936ddbc31f561508e8d658337 Mon Sep 17 00:00:00 2001 From: =?UTF-8?q?Micka=C3=ABl=20V=C3=A9ril?= Date: Sun, 27 Sep 2020 13:44:01 +0200 Subject: [PATCH] Fix cyanogen.xyz GS --- static/data/structures/QUEST3/cyanogen.xyz | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/static/data/structures/QUEST3/cyanogen.xyz b/static/data/structures/QUEST3/cyanogen.xyz index f2e77fe8..fe1e58fe 100644 --- a/static/data/structures/QUEST3/cyanogen.xyz +++ b/static/data/structures/QUEST3/cyanogen.xyz @@ -1,6 +1,6 @@ 4 ^1\Sigma_g^+,CC3,aug-cc-pVTZ - 0.00000000 0.00000000 0.69005726 +C 0.00000000 0.00000000 0.69005726 C 0.00000000 0.00000000 -0.69005726 N 0.00000000 0.00000000 1.85097785 N 0.00000000 0.00000000 -1.85097785