0 mol 5 unq 0 iso 0 dist 9.89833 7.77059 6.4543 3.99762 9.65106 6.86923 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 8.99402 8.16906 5.05883 11.426 6.77277 11.3311 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 6.98862 8.08224 5.03002 10.9364 9.44224 14.1023 numMergedOcc 0
3 mol 120 unq 0 iso 0 dist 9.18835 7.06763 7.47617 3.79204 9.74582 10.1866 numMergedOcc 0
4 mol 126 unq 0 iso 0 dist 7.25133 5.78493 4.32945 11.2933 9.55276 12.4743 numMergedOcc 0
5 mol 175 unq 0 iso 0 dist 6.03184 8.06007 9.57126 4.40729 5.25888 10.4251 numMergedOcc 0
6 mol 206 unq 0 iso 0 dist 4.51269 5.73198 4.22218 8.44632 8.75397 12.5676 numMergedOcc 0
7 mol 206 unq 1 iso 0 dist 7.65323 5.73198 3.57449 9.10202 8.75124 10.5903 numMergedOcc 0
8 mol 209 unq 0 iso 0 dist 8.12883 5.88616 5.09635 10.2809 8.21628 11.8194 numMergedOcc 0
9 mol 210 unq 0 iso 0 dist 6.41444 7.95917 5.30972 7.35484 8.14122 6.58557 numMergedOcc 0
10 mol 239 unq 0 iso 0 dist 7.21466 8.99104 10.3384 6.18958 8.39251 14.0087 numMergedOcc 0
11 mol 244 unq 0 iso 0 dist 6.51428 9.3491 12.2668 9.74679 8.95246 16.1802 numMergedOcc 0
12 mol 244 unq 1 iso 0 dist 6.51428 9.3491 12.2668 5.65728 5.97452 12.2614 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 9.77392 6.48382 16.2409 9.64323 7.96955 14.8852 numMergedOcc 0
14 mol 274 unq 0 iso 0 dist 6.12202 8.67957 12.2201 6.75848 9.70022 10.4427 numMergedOcc 0
15 mol 280 unq 0 iso 0 dist 7.02503 7.00616 3.76721 9.29964 9.93207 12.1713 numMergedOcc 0
16 mol 280 unq 1 iso 0 dist 9.18164 9.19653 3.76721 6.53984 9.93207 12.1713 numMergedOcc 0
