0 mol 34 unq 0 iso 0 dist 7.05327 7.52842 6.29842 11.0679 4.465 8.63361 9.33027 6.35031 6.15801 5.89577 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 7.05327 7.52842 6.29842 11.0679 4.465 8.63361 7.32707 5.50427 9.63403 6.62645 numMergedOcc 0
2 mol 34 unq 2 iso 0 dist 7.05327 7.52842 6.29842 11.0679 4.465 8.63361 11.0429 5.12822 8.07314 6.27366 numMergedOcc 0
3 mol 34 unq 3 iso 0 dist 9.29284 6.51847 6.29842 12.3478 4.465 8.63361 8.2946 6.35031 6.15801 5.89577 numMergedOcc 0
4 mol 34 unq 4 iso 0 dist 9.29284 6.51847 6.29842 12.3478 4.465 8.63361 9.25346 5.50427 9.63403 6.62645 numMergedOcc 0
5 mol 34 unq 5 iso 0 dist 9.29284 6.51847 6.29842 12.3478 4.465 8.63361 13.1502 5.12822 8.07314 6.27366 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 6.50336 11.1956 8.88454 11.074 5.50466 8.93453 4.25566 3.80087 9.78667 9.21506 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 6.50336 11.1956 8.88454 11.074 5.50466 8.93453 7.31037 3.80763 6.73983 4.38393 numMergedOcc 0
8 mol 141 unq 2 iso 0 dist 6.50336 11.1956 8.88454 11.074 5.50466 8.93453 13.4855 9.98068 7.64956 6.06881 numMergedOcc 0
9 mol 143 unq 0 iso 0 dist 8.08798 7.12863 5.66207 6.40901 7.87644 5.73236 9.30424 4.5497 6.95372 5.99865 numMergedOcc 0
10 mol 152 unq 0 iso 0 dist 9.70169 6.73177 5.42715 13.5692 4.78989 8.60521 11.4982 5.83776 5.06613 7.72754 numMergedOcc 0
11 mol 156 unq 0 iso 0 dist 8.22067 5.33988 5.22104 10.8344 6.69196 5.90883 6.05323 5.64188 7.46845 11.3995 numMergedOcc 0
12 mol 156 unq 1 iso 0 dist 8.22067 5.33988 5.22104 11.6744 7.91467 8.06913 6.05323 5.64188 7.46845 11.6326 numMergedOcc 0
13 mol 156 unq 2 iso 0 dist 8.90564 4.24398 5.22104 9.39865 6.69196 5.90883 9.67663 5.64188 7.46845 11.3995 numMergedOcc 0
14 mol 156 unq 3 iso 0 dist 8.90564 4.24398 5.22104 11.9353 7.91467 8.06913 9.67663 5.64188 7.46845 11.6326 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 6.24036 8.70275 8.46395 12.7829 9.42515 7.23293 9.49226 5.39534 5.45675 5.91678 numMergedOcc 0
16 mol 193 unq 0 iso 0 dist 6.17074 5.08201 7.06636 8.76185 5.43768 6.22972 10.3878 6.18551 9.41624 3.98356 numMergedOcc 0
17 mol 218 unq 0 iso 0 dist 9.39609 5.84583 6.45381 13.4879 10.6889 8.93185 12.6911 3.90135 8.3087 9.99277 numMergedOcc 0
18 mol 237 unq 0 iso 0 dist 8.33629 9.38038 8.96803 15.9366 13.4452 7.63812 5.98039 4.50383 6.07878 11.0622 numMergedOcc 0
19 mol 237 unq 1 iso 0 dist 8.33629 9.38038 8.96803 15.9366 13.4452 7.63812 9.48932 9.41259 7.80422 9.12884 numMergedOcc 0
20 mol 237 unq 2 iso 0 dist 8.33629 9.38038 8.96803 15.9366 13.4452 7.63812 11.5576 12.5736 5.06628 6.26206 numMergedOcc 0
21 mol 237 unq 3 iso 0 dist 8.33629 9.38038 8.96803 13.351 14.1628 8.51129 5.98039 4.50383 6.07878 10.1757 numMergedOcc 0
22 mol 237 unq 4 iso 0 dist 8.33629 9.38038 8.96803 13.351 14.1628 8.51129 9.48932 9.41259 7.80422 5.77883 numMergedOcc 0
23 mol 237 unq 5 iso 0 dist 8.33629 9.38038 8.96803 13.351 14.1628 8.51129 11.5576 12.5736 5.06628 3.97854 numMergedOcc 0
24 mol 260 unq 0 iso 0 dist 8.8385 7.45924 4.64695 12.6538 4.05076 8.3149 14.0908 7.28821 7.99521 7.16782 numMergedOcc 0
