diff --git a/pyrazine/cc-pvdz/pyrazine.xyz b/pyrazine/cc-pvdz/pyrazine.xyz
new file mode 100644
index 0000000..7310155
--- /dev/null
+++ b/pyrazine/cc-pvdz/pyrazine.xyz
@@ -0,0 +1,12 @@
+10
+
+C    0.00000000            2.13188686            1.31510863                     
+C    0.00000000           -2.13188686            1.31510863                     
+C    0.00000000            2.13188686           -1.31510863                     
+C    0.00000000           -2.13188686           -1.31510863                     
+N    0.00000000            0.00000000            2.66620111                     
+N    0.00000000            0.00000000           -2.66620111                     
+H    0.00000000            3.88751412            2.35234226                     
+H    0.00000000           -3.88751412            2.35234226                     
+H    0.00000000            3.88751412           -2.35234226                     
+H    0.00000000           -3.88751412           -2.35234226                     
diff --git a/pyrazine/cc-pvdz/run_fci.sh b/pyrazine/cc-pvdz/run_fci.sh
new file mode 100644
index 0000000..4df0dd8
--- /dev/null
+++ b/pyrazine/cc-pvdz/run_fci.sh
@@ -0,0 +1,22 @@
+#!/bin/bash -x
+#SBATCH -N 1  # 1 noeud
+#SBATCH -n 1  # 1 processus
+#SBATCH -c 36  # 36 coeurs
+
+INPUT=$1
+source ~/tmpdir/qp2/quantum_package.rc
+
+set -e 
+qp set_file $INPUT
+qp set determinants n_states 1 
+qp set determinants read_wf True
+qp set determinants s2_eig False
+qp set determinants n_det_max 1e7
+qp run scf > ${INPUT}.scf.out
+qp set_frozen_core > ${INPUT}.fc.out
+qp run fci > ${INPUT}.fci.out || :
+qp run save_natorb > ${INPUT}.natorb.out
+qp set determinants n_det_max 1e8
+qp run fci > ${INPUT}.nofci.out
+
+