0 mol 10 unq 0 iso 0 dist 9.64885 12.6301 6.74091 17.0524 10.2455 9.38983 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.5774 6.55499 7.77333 9.72316 9.48052 8.38803 numMergedOcc 0
2 mol 61 unq 0 iso 0 dist 8.22998 5.33982 8.65313 12.5899 11.062 8.6338 numMergedOcc 0
3 mol 61 unq 1 iso 0 dist 8.22998 5.33982 8.65313 12.1299 9.46692 7.63159 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 9.27428 4.06023 9.12256 7.45405 5.92844 4.77515 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 6.20262 7.59533 5.59311 5.99206 6.14253 9.56319 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 6.20262 7.59533 5.59311 7.4615 4.88407 6.65267 numMergedOcc 0
7 mol 133 unq 2 iso 0 dist 6.20262 9.61802 5.7232 5.99206 6.14253 9.73038 numMergedOcc 0
8 mol 141 unq 0 iso 0 dist 9.1253 5.21014 6.65051 10.4067 6.02176 8.52591 numMergedOcc 0
9 mol 141 unq 1 iso 0 dist 9.47583 5.21014 9.41519 10.4067 5.44444 8.52591 numMergedOcc 0
10 mol 185 unq 0 iso 0 dist 5.03982 9.26357 7.5578 5.80107 3.55732 8.83768 numMergedOcc 0
11 mol 185 unq 1 iso 0 dist 5.03982 9.73349 6.06763 14.0625 9.15037 8.85182 numMergedOcc 0
12 mol 185 unq 2 iso 0 dist 5.03982 9.73349 6.06763 5.80107 3.55732 5.7065 numMergedOcc 0
13 mol 226 unq 0 iso 0 dist 7.35204 12.3268 7.9801 15.1734 8.45224 5.71182 numMergedOcc 0
14 mol 226 unq 1 iso 0 dist 7.35204 9.69333 6.17825 13.9617 8.7629 9.03261 numMergedOcc 0
15 mol 226 unq 2 iso 0 dist 7.35204 9.69333 6.17825 15.1734 8.45224 7.67573 numMergedOcc 0
16 mol 265 unq 0 iso 0 dist 6.6013 4.50567 8.09021 10.0004 15.4423 9.94957 numMergedOcc 0
17 mol 265 unq 1 iso 0 dist 7.85422 4.50567 6.98451 10.0004 11.3503 9.94957 numMergedOcc 0
18 mol 268 unq 0 iso 0 dist 7.90656 4.51589 9.7384 9.87171 10.2436 6.62669 numMergedOcc 0
19 mol 268 unq 1 iso 0 dist 7.90656 4.51589 9.7384 7.59787 4.84665 9.73984 numMergedOcc 0
