0 mol 1 unq 0 iso 0 dist 9.48433 10.1549 9.00903 6.28655 8.56884 9.01967 12.6995 6.09918 7.94662 8.78328 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 9.73896 5.84852 6.43774 7.06216 7.06308 4.71384 11.1814 6.06454 5.73693 5.94047 numMergedOcc 0
2 mol 45 unq 1 iso 0 dist 6.96797 5.84852 7.2846 7.06216 6.34173 4.71384 11.1814 9.44459 5.73693 5.94047 numMergedOcc 0
3 mol 45 unq 2 iso 0 dist 6.96797 6.5822 7.58835 7.06216 6.34173 5.67689 11.1814 9.44459 11.6164 5.94047 numMergedOcc 0
4 mol 52 unq 0 iso 0 dist 8.52979 11.4352 9.80098 13.1241 7.18176 5.93337 8.23954 9.66501 4.88603 8.75928 numMergedOcc 0
5 mol 52 unq 1 iso 0 dist 8.52979 14.6092 7.34143 13.1241 7.18176 4.5482 8.23954 9.66501 12.277 8.75928 numMergedOcc 0
6 mol 131 unq 0 iso 0 dist 6.44766 7.69184 6.85062 8.49634 6.91348 6.19596 13.6401 9.29384 9.32969 6.01893 numMergedOcc 0
7 mol 131 unq 1 iso 0 dist 6.44766 7.69184 6.85062 5.0492 9.51418 6.6499 13.6401 9.29384 9.32969 15.1974 numMergedOcc 0
8 mol 134 unq 0 iso 0 dist 8.5778 10.2414 6.54501 17.082 8.6355 10.1448 7.63514 5.53031 5.35679 11.9544 numMergedOcc 0
9 mol 134 unq 1 iso 0 dist 8.5778 13.5276 6.49416 17.082 8.6355 5.41704 7.63514 5.53031 8.46636 11.9544 numMergedOcc 0
10 mol 204 unq 0 iso 0 dist 9.65951 11.5989 7.10633 10.8926 5.90931 5.09262 13.1567 6.85441 8.17229 10.7974 numMergedOcc 0
11 mol 204 unq 1 iso 0 dist 9.65951 9.99471 8.51516 10.8926 5.90931 12.9483 13.1567 6.85441 5.74707 10.7974 numMergedOcc 0
12 mol 204 unq 2 iso 0 dist 9.14829 6.73339 7.10633 5.63477 5.90931 5.09262 13.1156 6.85441 8.17229 10.7974 numMergedOcc 0
13 mol 204 unq 3 iso 0 dist 9.14829 13.2127 8.51516 5.63477 5.90931 12.9483 13.1156 6.85441 5.74707 10.7974 numMergedOcc 0
14 mol 214 unq 0 iso 0 dist 9.33638 15.9383 9.65138 11.401 6.97182 6.16485 13.6007 6.38157 7.38025 9.26037 numMergedOcc 0
15 mol 214 unq 1 iso 0 dist 9.33638 15.9383 9.65138 6.39677 6.1175 11.5712 13.6007 6.38157 7.38025 11.353 numMergedOcc 0
16 mol 214 unq 2 iso 0 dist 9.33638 7.31241 7.14453 11.401 6.97182 5.33565 13.6007 6.38157 9.35273 9.26037 numMergedOcc 0
17 mol 214 unq 3 iso 0 dist 9.33638 7.31241 7.14453 6.39677 6.1175 5.06792 13.6007 6.38157 9.35273 11.353 numMergedOcc 0
18 mol 214 unq 4 iso 0 dist 9.33638 17.0758 8.85478 11.401 6.97182 8.47007 13.6007 6.38157 5.63388 9.26037 numMergedOcc 0
19 mol 214 unq 5 iso 0 dist 9.33638 17.0758 8.85478 6.39677 6.1175 12.8334 13.6007 6.38157 5.63388 11.353 numMergedOcc 0
20 mol 220 unq 0 iso 0 dist 9.05754 15.9524 9.23153 9.9115 6.84247 6.7067 11.3947 5.45036 6.17628 5.49803 numMergedOcc 0
21 mol 220 unq 1 iso 0 dist 9.05754 15.9524 9.23153 9.9115 6.84247 6.7067 5.70392 9.97586 14.0253 7.44322 numMergedOcc 0
22 mol 220 unq 2 iso 0 dist 9.05754 15.9524 9.23153 5.53308 6.99002 15.9568 11.3947 5.45036 6.17628 11.2241 numMergedOcc 0
23 mol 220 unq 3 iso 0 dist 9.05754 15.9524 9.23153 5.53308 6.99002 15.9568 5.70392 9.97586 14.0253 9.68359 numMergedOcc 0
24 mol 220 unq 4 iso 0 dist 9.05754 10.0641 8.24498 9.9115 6.84247 6.05129 11.3947 5.45036 10.4136 5.49803 numMergedOcc 0
25 mol 220 unq 5 iso 0 dist 9.05754 10.0641 8.24498 9.9115 6.84247 6.05129 5.70392 9.97586 6.20511 7.44322 numMergedOcc 0
26 mol 220 unq 6 iso 0 dist 9.05754 10.0641 8.24498 5.53308 6.99002 11.1321 11.3947 5.45036 10.4136 11.2241 numMergedOcc 0
27 mol 220 unq 7 iso 0 dist 9.05754 10.0641 8.24498 5.53308 6.99002 11.1321 5.70392 9.97586 6.20511 9.68359 numMergedOcc 0
28 mol 234 unq 0 iso 0 dist 8.58958 16.0172 8.34494 6.99882 6.25105 10.3337 14.2602 8.24186 11.7705 13.0974 numMergedOcc 0
29 mol 234 unq 1 iso 0 dist 8.58958 14.7629 6.56247 6.99882 6.25105 11.216 14.2602 8.24186 5.63086 13.0974 numMergedOcc 0
30 mol 234 unq 2 iso 0 dist 8.58958 13.5847 9.36357 6.99882 6.25105 11.4315 14.2602 8.24186 5.6819 13.0974 numMergedOcc 0
31 mol 234 unq 3 iso 0 dist 9.70004 10.9359 8.34494 7.22134 6.25105 10.3337 17.7658 8.24186 11.7705 13.0974 numMergedOcc 0
32 mol 234 unq 4 iso 0 dist 9.70004 14.3229 6.56247 7.22134 6.25105 11.216 17.7658 8.24186 5.63086 13.0974 numMergedOcc 0
33 mol 234 unq 5 iso 0 dist 9.70004 17.5883 9.36357 7.22134 6.25105 11.4315 17.7658 8.24186 5.6819 13.0974 numMergedOcc 0
34 mol 234 unq 6 iso 0 dist 7.17987 14.7629 9.45496 5.04225 9.5707 15.9563 14.2602 7.5366 5.63086 16.5499 numMergedOcc 0
35 mol 234 unq 7 iso 0 dist 7.17987 14.7629 9.45496 6.99882 7.85175 11.216 14.2602 7.5366 5.63086 13.0974 numMergedOcc 0
36 mol 234 unq 8 iso 0 dist 7.17987 13.5847 6.7625 5.04225 9.5707 14.4106 14.2602 7.5366 5.6819 16.5499 numMergedOcc 0
37 mol 234 unq 9 iso 0 dist 7.17987 13.5847 6.7625 6.99882 7.85175 11.4315 14.2602 7.5366 5.6819 13.0974 numMergedOcc 0
38 mol 253 unq 0 iso 0 dist 9.75753 15.0268 9.02271 12.2787 7.19465 7.92528 14.9103 7.77998 13.6942 14.5407 numMergedOcc 0
