0 mol 28 unq 0 iso 0 dist 6.53312 5.06086 7.10923 5.98169 10.6136 8.11586 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 7.6912 6.78966 3.52799 7.03969 3.43614 6.20443 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 7.83864 7.39252 7.77361 9.55065 3.50148 10.6815 numMergedOcc 0
3 mol 79 unq 0 iso 0 dist 7.18358 7.52639 9.09552 6.29801 5.73969 3.40476 numMergedOcc 0
4 mol 81 unq 0 iso 0 dist 6.03428 9.78763 9.95888 7.94697 7.93947 4.52409 numMergedOcc 0
5 mol 81 unq 1 iso 0 dist 6.03428 9.61137 11.1271 7.94697 7.93947 5.89527 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 9.04398 5.6738 11.3166 6.38269 8.81921 4.62493 numMergedOcc 0
7 mol 113 unq 1 iso 0 dist 9.04398 5.6738 11.3166 7.11196 6.384 6.47997 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 5.99873 5.29259 3.46142 8.18193 6.83136 9.61655 numMergedOcc 0
9 mol 119 unq 0 iso 0 dist 4.90449 9.12113 6.33908 6.3646 3.80816 9.70371 numMergedOcc 0
10 mol 159 unq 0 iso 0 dist 8.61918 7.85513 4.44253 8.11352 3.55677 4.31404 numMergedOcc 0
11 mol 171 unq 0 iso 0 dist 8.30819 6.07578 12.3288 8.00826 11.244 8.3501 numMergedOcc 0
12 mol 176 unq 0 iso 0 dist 6.55106 8.27087 4.57491 6.32254 3.58164 5.64063 numMergedOcc 0
13 mol 176 unq 1 iso 0 dist 8.08891 7.71329 4.57491 8.89556 3.58164 5.64063 numMergedOcc 0
14 mol 272 unq 0 iso 0 dist 6.20857 8.02328 3.62419 7.08918 8.90381 12.3473 numMergedOcc 0
15 mol 292 unq 0 iso 0 dist 6.38051 5.43095 3.41551 4.97488 5.55248 3.98487 numMergedOcc 0
