0 mol 43 unq 0 iso 0 dist 9.05728 6.34215 9.49478 8.43173 14.9221 6.57633 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 8.62669 8.79235 10.4432 12.2389 15.8072 5.63499 numMergedOcc 0
2 mol 54 unq 0 iso 0 dist 8.62769 9.87963 4.02037 11.0441 9.20429 8.73588 numMergedOcc 0
3 mol 54 unq 1 iso 0 dist 6.09782 8.67352 4.02037 9.19015 9.20429 8.73588 numMergedOcc 0
4 mol 67 unq 0 iso 0 dist 7.9572 6.44825 9.25732 4.94708 11.873 9.83555 numMergedOcc 0
5 mol 67 unq 1 iso 0 dist 8.64208 6.44825 13.625 4.94708 9.2223 9.83555 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 7.15203 9.7105 6.9945 5.20083 10.229 8.89346 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 8.44823 6.75471 9.85734 10.0143 16.0038 7.94976 numMergedOcc 0
8 mol 155 unq 0 iso 0 dist 8.66709 5.55218 7.10286 5.55092 8.57712 8.99128 numMergedOcc 0
9 mol 162 unq 0 iso 0 dist 9.42819 6.51243 5.65603 7.51816 7.69229 9.65468 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 9.63295 8.39573 5.93724 8.66115 11.1074 5.97971 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 9.63295 8.39573 5.93724 6.02642 12.2168 8.72747 numMergedOcc 0
12 mol 181 unq 2 iso 0 dist 9.63295 8.39573 5.93724 7.62243 10.8515 8.23845 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 8.32829 8.25953 15.9879 4.84679 11.1127 8.09915 numMergedOcc 0
14 mol 217 unq 0 iso 0 dist 5.10683 6.58871 4.64118 7.49329 6.23025 8.99484 numMergedOcc 0
15 mol 224 unq 0 iso 0 dist 7.04127 5.36326 5.13732 3.74681 10.2007 8.565 numMergedOcc 0
16 mol 230 unq 0 iso 0 dist 8.56954 9.3974 12.7772 5.70986 11.7506 6.75627 numMergedOcc 0
17 mol 230 unq 1 iso 0 dist 9.23938 9.3974 8.67903 5.70986 9.76154 6.75627 numMergedOcc 0
18 mol 279 unq 0 iso 0 dist 5.17586 7.03656 8.4236 7.77606 9.24472 8.30375 numMergedOcc 0
